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ブロモキシレン

Benzene, 2-bromo-1,4-dimethyl-

HCID 11121
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基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
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基本情報

CAS
28258-59-5
標準SMILES
Cc1ccc(C)c(Br)c1
InChIKey
QXISTPDUYKNPLU-UHFFFAOYSA-N
分子式
C8H9Br
平均分子量
185.06 g/mol
単同位体質量
183.98876

概要

Xylyl bromide appears as colorless crystals or a clear colorless liquid. Vapors extremely irritate the eyes and mucous membranes.

名称と識別子

優先名称
Benzene, 2-bromo-1,4-dimethyl-
IUPAC
2-bromo-1,4-dimethylbenzene
現地名
ブロモキシレン
英語名
Bromoxylene
分子式
C8H9Br
分子量
185.06

名称と別名

2,5-Dimethylbromobenzene2-Bromo-p-xylene2-Bromo-1,4-dimethylbenzene1-Bromo-2,5-dimethylbenzeneBenzene, 2-bromo-1,4-dimethyl-Bromo-p-xylene35884-77-62,5-Xylyl bromidep-Xylene, 2-bromo-XYLYL BROMIDE2,5-Dimethylphenyl bromide2-Bromo-1,4-xylene
名称をさらに表示
ブロモキシレン
NSC 8051EINECS 209-055-7DTXSID9060289BromoxyleneMonobromoxylenealphaBromoxylenealpha-BromoxyleneBenzene, bromodimethyl

データベース識別子

CAS
28258-59-5、35884-77-6、553-94-6
PubChem CID
11121
DTXSID
DTXSID9060289
EC Number
209-055-7
Nikkaji
J31.756J

物性

構造計算による物性

XLogP
3.4
極性表面積
0 Ų
水素結合供与体数
0
水素結合受容体数
0
回転可能結合数
0
重原子数
9
形式電荷
0
複雑度
90.6

実験および物理化学的性質

Chemical ClassesOther Classes -> Halogenated Monoaromatics
SpringerMaterials PropertiesBoiling point
Density1.4
Color/Form · 2 件

Colorless crystals or clear colorless liquid

Colorless liquid

Boiling Point210-220 °C
Decomposition · 2 件

Decomposed slowly by water.

When heated to decomposition it emits toxic fumes of Br-.

Physical Description · 2 件

Xylyl bromide appears as colorless crystals or a clear colorless liquid. Vapors extremely irritate the eyes and mucous membranes.

Clear liquid with aromatic odor (mixture of isomers); [Hawley]

Other Experimental Properties · 3 件

Decomposed slowly by water

Mixed ortho-, meta-, and para-isomers

Strong irritant to eyes, skin, and tissue

物理化学的性質

EPAの化学物質情報
Xylyl bromide (28258-59-5)

安全と法規制

安全情報は参考情報です。供給元の安全データシート(SDS)、適用法令、専門家による評価に代わるものではありません。

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory InformationThe New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
DOT LabelPoison
Fire Hazards · 3 件

Excerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:

· Combustible material: may burn but does not ignite readily.

· Combustible material: may burn but does not ignite readily.

Fire PotentialCombustible
Health Hazards · 3 件

Excerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:

· Highly toxic, may be fatal if inhaled, ingested or absorbed through skin.

· Highly toxic, may be fatal if inhaled, ingested or absorbed through skin.

Hazards SummaryA strong lachrymator; [HSDB] Toxic by ingestion and inhalation; Strong irritant; [Hawley] See m-Xylyl bromide, o-Xylyl bromide, and p-Xylyl bromide.
DOT ID and Guide · 2 件

3417 152

1701 152

Reactive GroupAryl Halides
Reactivity Profile · 1 件

Simple aromatic halogenated organic compounds, such as XYLYL BROMIDE, are very unreactive. Halogenated organics generally become less reactive as more of their hydrogen atoms are replaced with halogen atoms. Materials in this group may be incompatible with strong oxidizing and reducing agents. Also, they may be incompatible with many amines, nitrides, azo/diazo compounds, alkali metals, and epoxides.

History and Incidents · 1 件

World War I was the conflict, during which it was first used chemical warfare on a massive scale. The earliest chemical attack occurred on the Western Front in October 1914 in Neuve Chapelle, but its effects were so minimal that the Allies learned about it only after the war from German documents. The attack in the area Bolimow, made by the Germans against the Russian army with artillery shells containing gas T (xylyl and benzyl bromides), was therefore the first attack on a massive scale recorded on the victim side. The attack, which occurred after it made it possible to obtain some tactical success, but without a strategic breakthrough. Some of the later German attacks on the eastern front where chlorine was used proved to be more effective, but despite the many victims there was not any major strategic success achieved. The Russians did not take attempts to use chemical weapons in the First World War.

DOT Emergency Guidelines · 5 件

/GUIDE 152: SUBSTANCES - TOXIC (COMBUSTIBLE)/ Health: Highly toxic, may be fatal if inhaled, swallowed or absorbed through skin. Contact with molten substance may cause severe burns to skin and eyes. Avoid any skin contact. Effects of contact or inhalation may be delayed. Fire may produce irritating, corrosive and/or toxic gases. Runoff from fire control or dilution water may be corrosive and/or toxic and cause pollution. /Xylyl bromide; Xylyl bromide, liquid; Xylyl bromide, solid/

/GUIDE 152: SUBSTANCES - TOXIC (COMBUSTIBLE)/ Fire or Explosion: Combustible material: may burn but does not ignite readily. Containers may explode when heated. Runoff may pollute waterways. Substance may be transported in a molten form. /Xylyl bromide; Xylyl bromide, liquid; Xylyl bromide, solid/

/GUIDE 152: SUBSTANCES - TOXIC (COMBUSTIBLE)/ Public Safety: CALL Emergency Response Telephone Number ... As an immediate precautionary measure, isolate spill or leak area in all directions for at least 50 meters (150 feet) for liquids and at least 25 meters (75 feet) for solids. Keep unauthorized personnel away. Stay upwind. Keep out of low areas. /Xylyl bromide; Xylyl bromide, liquid; Xylyl bromide, solid/

/GUIDE 152: SUBSTANCES - TOXIC (COMBUSTIBLE)/ Protective Clothing: Wear positive pressure self-contained breathing apparatus (SCBA). Wear chemical protective clothing that is specifically recommended by the manufacturer. It may provide little or no thermal protection. Structural firefighters' protective clothing provides limited protection in fire situations ONLY; it is not effective in spill situations where direct contact with the substance is possible. /Xylyl bromide; Xylyl bromide, liquid; Xylyl bromide, solid/

For more DOT Emergency Guidelines (Complete) data for XYLYL BROMIDE (8 total), please visit the HSDB record page.

DOT Hazard Classification · 6 件

Xylyl bromide, liquid

UN1701

Div 6.1 Poisonous materials (49 eCFR § 173.132)

PG II: the degree of danger presented by the material is medium

Xylyl bromide, solid

UN3417

安全と保護具

Fire FightingExcerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:
Accidental Release Measures · 4 件

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 3 件

Excerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:

General First Aid:

General First Aid:

Exposure Control and Personal Protection · 2 件

· Wear positive pressure self-contained breathing apparatus (SCBA).

· Wear positive pressure self-contained breathing apparatus (SCBA).

Fire Fighting Procedures · 2 件

If material on fire or involved in fire: Use water in flooding quantities as fog. Use "alcohol" foam, dry chemical or carbon dioxide. Cool all affected containers with flooding quantities of water. Use water spray to knock-down vapors. /Xylyl bromide, liquid; Xylyl bromide, solid/

Personnel protection: ... Wear positive pressure self-contained breathing apparatus when fighting fires involving this material. /Xylyl bromide, liquid; Xylyl bromide, solid/

Nonfire Spill ResponseExcerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:
Disposal Methods · 1 件

SRP: The most favorable course of action is to use an alternative chemical product with less inherent propensity for occupational harm/injury/toxicity or environmental contamination. Recycle any unused portion of the material for its approved use or return it to the manufacturer or supplier. Ultimate disposal of the chemical must consider: the material's impact on air quality; potential migration in soil or water; effects on animal and plant life; and conformance with environmental and public health regulations.

Preventive Measures · 3 件

If material not on fire and not involved in fire: Keep sparks, flames, and other sources of ignition away. Keep material out of water sources and sewers. Use water spray to knock-down vapors. /Xylyl bromide, liquid; Xylyl bromide, solid/

Personnel protection: Avoid breathing vapors. Keep upwind. ... Avoid bodily contact with the material. ... Do not handle broken packages unless wearing appropriate personal protective equipment. Wash away any material which may have contacted the body with copious amounts of water or soap and water. ... If contact with the material anticipated, wear appropriate chemical protective clothing. /Xylyl bromide, liquid; Xylyl bromide, solid/

SRP: The scientific literature for the use of contact lenses by industrial workers is inconsistent. The benefits or detrimental effects of wearing contact lenses depend not only upon the substance, but also on factors including the form of the substance, characteristics and duration of the exposure, the uses of other eye protection equipment, and the hygiene of the lenses. However, there may be individual substances whose irritating or corrosive properties are such that the wearing of contact lenses would be harmful to the eye. In those specific cases, contact lenses should not be worn. In any event, the usual eye protection equipment should be worn even when contact lenses are in place.

Isolation and Evacuation · 3 件

Excerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:

Immediate precautionary measure

Immediate precautionary measure

Personal Protective Equipment (PPE) · 2 件

Excerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:

Personnel protection: ... Wear positive pressure self-contained breathing apparatus. ... Wear appropriate chemical protective gloves, boots, and googles. /Xylyl bromide, liquid; Xylyl bromide, solid/

Emergency Response Planning Guidelines · 2 件

Small Fire

Small Fire

毒性情報

Adverse EffectsLacrimator (Lachrymator) - A substance that irritates the eyes and induces the flow of tears.
Human Toxicity Excerpts · 2 件

/OTHER TOXICITY INFORMATION/ Toxic by inhalation, and ingestion.

/OTHER TOXICITY INFORMATION/ ... Strongly lacrimatory.

Antidote and Emergency Treatment · 5 件

Immediate first aid: Ensure that adequate decontamination has been carried out. If patient is not breathing, start artificial respiration, preferably with a demand-valve resuscitator, bag-valve-mask device, or pocket mask, as trained. Perform CPR as necessary. Immediately flush contaminated eyes with gently flowing water. Do not induce vomiting. If vomiting occurs, lean patient forward or place on left side (head-down position, if possible) to maintain an open airway and prevent aspiration. Keep patient quiet and maintain normal body temperature. Obtain medical attention. /Bromine, methyl bromide, and related compounds/

Basic treatment: Establish a patent airway (oropharyngeal or nasopharyngeal airway, if needed). Suction if necessary. Watch for signs of respiratory insufficiency and assist ventilations if necessary. Administer oxygen by nonrebreather mask at 10 to 15 L/min. Monitor for pulmonary edema and treat if necessary ... . Monitor for shock and treat if necessary ... . Anticipate seizures and treat if necessary ... . For eye contamination, flush eyes immediately with water. Irrigate each eye continuously with 0.9% saline (NS) during transport ... . Do not use emetics. For ingestion, rinse mouth and administer 5 mL/kg up to 200 mL of water for dilution if the patient can swallow, has a strong gag reflex, and does not drool. Administer activated charcoal ... . Cover skin burns with dry sterile dressings after decontamination ... . /Bromine, methyl bromide, and related compounds/

Advanced treatment: Consider orotracheal or nasotracheal intubation for airway control in the patient who is unconscious, has severe pulmonary edema, or is in severe respiratory distress. Positive-pressure ventilation techniques with a bag valve mask device may be beneficial. Consider drug therapy for pulmonary edema ... . Consider administering a beta agonist such as albuterol for severe bronchospasm ... . Monitor cardiac rhythm and treat arrhythmias if necessary ... . Start IV administration of D5W /SRP: "To keep open", minimal flow rate/. Use 0.9% saline (NS) or lactated Ringer's (LR) if signs of hypovolemia are present. For hypotension with signs of hypovolemia, administer fluid cautiously. Consider vasopressors if patient is hypotensive with a normal fluid volume. Watch for signs of fluid overload ... . Treat seizures with diazepam or lorazepam ... . Use proparacaine hydrochloride to assist eye irrigation ... . /Bromine, methyl bromide, and related compounds/

Immediate first aid: Ensure that adequate decontamination has been carried out. If patient is not breathing, start artificial respiration, preferably with a demand-valve resuscitator, bag-valve-mask device, or pocket mask, as trained. Perform CPR as necessary. Immediately flush contaminated eyes with gently flowing water. Do not induce vomiting. If vomiting occurs, lean patient forward or place on left side (head-down position, if possible) to maintain an open airway and prevent aspiration. Keep patient quiet and maintain normal body temperature. Obtain medical attention. /Aromatic hydrocarbons and related compounds/

For more Antidote and Emergency Treatment (Complete) data for XYLYL BROMIDE (6 total), please visit the HSDB record page.

化学と産業

用途と製造

Uses · 4 件

Used as a tear gas and to produce other organic chemicals; [Hawley]

Organic synthesis, tear gas

In war-gas formulations /o, m, p isomers/

A poison.

Methods of ManufacturingBromination of xylene.
Formulations/PreparationsGrade: Technical
General Manufacturing Information · 2 件

Benzene, 2-bromo-1,4-dimethyl-: ACTIVE

World War I was the /first/ conflict, during which ... chemical warfare /was used/ on a massive scale. The earliest chemical attack occurred on the Western Front in October 1914 in Neuve Chapelle, but its effects were so minimal that the Allies learned about it only after the war from German documents. The attack in the area Bolimow, made by the Germans against the Russian army with artillery shells containing gas T (xylyl and benzyl bromides), was therefore the first attack on a massive scale recorded on the victim side. The attack, which occurred after it made it possible to obtain some tactical success, but without a strategic breakthrough. Some of the later German attacks on the eastern front where chlorine was used proved to be more effective, but despite the many victims there was not any major strategic success achieved. The Russians did not make attempts to use chemical weapons in the First World War.

関連反応

39 件
反応記録を作成
HRID 5045 の反応式
HRID 5045反応物としてuspto-grants-1993_09
HRID 153684 の反応式
HRID 153684反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 227848 の反応式
HRID 227848反応物としてuspto-grants-2009_07
HRID 227871 の反応式
HRID 227871反応物としてuspto-grants-2009_07
HRID 301167 の反応式
HRID 301167反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 382084 の反応式
HRID 382084反応物としてuspto-grants-2001_10
HRID 382106 の反応式
HRID 382106反応物としてuspto-grants-2001_10
HRID 394819 の反応式
HRID 394819反応物としてuspto-grants-2003_08
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