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2,3-エポキシ-1,1,1-トリクロロプロパン

2-(Trichloromethyl)oxirane

HCID 18321
ノート反応
基本情報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
部分構造検索類似構造を探す

基本情報

CAS
3083-23-6
標準SMILES
ClC(Cl)(Cl)C1CO1
InChIKey
VFEXYZINKMLLAK-UHFFFAOYSA-N
分子式
C3H3Cl3O
平均分子量
161.41 g/mol
単同位体質量
159.924948

名称と識別子

優先名称
2-(Trichloromethyl)oxirane
IUPAC
2-(trichloromethyl)oxirane
現地名
2,3-エポキシ-1,1,1-トリクロロプロパン
英語名
(trichloromethyl)oxirane
分子式
C3H3Cl3O
分子量
161.41

名称と別名

2-(Trichloromethyl)oxirane(Trichloromethyl)oxirane3083-23-61,2-Epoxy-3,3,3-trichloropropaneOxirane, (trichloromethyl)-Trichloroepoxypropane3,3,3-Trichloropropylene oxideTrichloropropylene oxide1,1,1-TRICHLORO-2,3-EPOXYPROPANE1,1,1-Trichloropropene oxide3,3,3-Trichloropropene oxide1,1,1-Trichloropropylene oxide
名称をさらに表示
2-(トリクロロメチル)オキシラン1,2-エポキシ-3,3,3-トリクロロプロパン2-トリクロロメチルオキシラン1,1,1-トリクロロ-2,3-エポキシプロパン3,3,3-トリクロロ1,2-エポキシプロパン2,3-エポキシ-1,1,1-トリクロロプロパン(トリクロロメチル)オキシランTRICHLOROPROPANEOXIDETRICHLOROPROPYLENEOXIDEOxirane, 2-(trichloromethyl)-3,3,3-TRICHLOROPROPYLENEOXIDE3,3,3-TRICHLOROPROPYLENE1,2-OXIDETrichloropropene Oxide Discontinued
3,3,3-TrichloroepoxypropanePropane, 1,1,1-trichloro-2,3-epoxy-1,1,1-Trichloro-2-propene oxide1,1,1-Trichloropropane 2,3-oxide1,1,1-Trichloropropene 2,3-oxide3,3,3-Trichloro-1,2-epoxypropane1,1,1-Trichloropropane 2,3-epoxide1,1,1-Trichloropropene-2,3-oxide

データベース識別子

CAS
3083-23-6
PubChem CID
18321
DTXSID
DTXSID3025251
UNII
IQ92Z3552X
EC Number
221-384-8
Nikkaji
J2.171G

物性

構造計算による物性

XLogP
1.8
極性表面積
12.5 Ų
水素結合供与体数
0
水素結合受容体数
1
回転可能結合数
0
重原子数
7
形式電荷
0
複雑度
76

実験および物理化学的性質

Density1.495 at 68 °F (NTP, 1992) - Denser than water; will sink
Solubilityless than 0.1 mg/mL at 65.3 °F (NTP, 1992)
Flash Point152 °F (NTP, 1992)
Boiling Point300 °F at 764 mmHg (NTP, 1992)
Vapor Pressure · 2 件

11.6 mmHg at 77 °F ; 28.5 mmHg at 108 °F; 65.5 mmHg at 149 °F (NTP, 1992)

11.6 [mmHg]

Physical Description · 2 件

1,2-epoxy-3,3,3-trichloropropane is a clear colorless liquid. (NTP, 1992)

Clear colorless liquid; [CAMEO]

Kovats Retention Index885

物理化学的性質

沸点
226.05 °C · 226.05°C (rough estimate)
比重(密度)
1.495 · 1.4950
屈折率
1.4737 · 1.4737 (estimate)
安定性
安定。可燃性。強力な酸化剤とは相容れない。
CAS データベース
3083 · 3083-23-6

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 · 5 件

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids];H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H351 (100%): Suspected of causing cancer [Warning Carcinogenicity];H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]

P203, P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

危険有害性情報

Fire HazardsThis chemical is combustible. (NTP, 1992)
Health HazardsACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits toxic fumes. (NTP, 1992)
Hazards SummaryIntraperitoneal LD50 (rat) = 142 mg/kg; [RTECS] Enhances the tumor initiating ability of some carcinogens; [ChemIDplus] Highly flammable and polymerizable; [CAMEO] See Epibromohydrin and Epichlorohydrin.
Reactive GroupHalogenated Organic Compounds;Epoxides;Polymerizable Compounds
Reactivity AlertsPolymerizable
Reactivity Profile

化学と産業

薬理情報

MeSH Pharmacological ClassificationCompounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction.

用途と製造

UsesUsed as a fireproofing agent and polymer intermediate; [NTP]

応用分野

使用Trichloropropene Oxide is a epoxide hydratase inhibitor and possess potential carcinogenic properties.

一般的な説明Clear colorless liquid.

サプライヤー7 社

安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
陕西缔都医药化工有限公司+86-029-81138252 +86-173 9270 1263 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

関連反応

7 件
反応記録を作成
HRID 127950 の反応式
HRID 127950反応物としてuspto-grants-1981_03
HRID 127954 の反応式
HRID 127954反応物としてuspto-grants-1981_03
HRID 152929 の反応式
HRID 152929反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1075145 の反応式
HRID 1075145反応物としてuspto-grants-1983_07
HRID 1763451 の反応式
HRID 1763451反応物としてuspto-grants-1978_09
HRID 2135484 の反応式
HRID 2135484反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID 2135818 の反応式
HRID 2135818反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

化合物ノート

読み込み中…

このページの内容基本情報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
EPAの化学物質情報
1 · 1,1,1-Trichloro-2,3-epoxypropane (3083-23-6)

化学的性質

化学的特性colourless liquid

· 1 件

Epoxides are highly reactive. They polymerize in the presence of catalysts or when heated. These polymerization reactions can be violent. Compounds in this group react with acids, bases, and oxidizing and reducing agents. They react, possibly violently with water in the presence of acid and other catalysts.

Air and Water ReactionsInsoluble in water.
Hazard Classes and CategoriesFlam. Liq. 3 (100%);Acute Tox. 4 (100%);Acute Tox. 4 (100%);Skin Irrit. 2 (100%);Eye Irrit. 2 (100%);Acute Tox. 4 (100%);STOT SE 3 (100%);Carc. 2 (100%);STOT RE 2 (100%)

安全と保護具

Fire FightingFires involving this compound should be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 件

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.;SKIN: IMMEDIATELY flood affected skin with water while removing and isolating all contaminated clothing. Gently wash all affected skin areas thoroughly with soap and water. If symptoms such as redness or irritation develop, IMMEDIATELY call a physician and be prepared to transport the victim to a hospital for treatment.;INHALATION: IMMEDIATELY leave the contaminated area; take deep breaths of fresh air. If symptoms (such as wheezing, coughing, shortness of breath, or burning in the mouth, throat, or chest) develop, call a physician and be prepared to transport the victim to a hospital. Provide proper respiratory protection to rescuers entering an unknown atmosphere. Whenever possible, Self-Contained Breathing Apparatus (SCBA) should be used; if not available, use a level of protection greater than or equal to that advised under Protective Clothing.;INGESTION: DO NOT INDUCE VOMITING. If the victim is conscious and not convulsing, give 1 or 2 glasses of water to dilute the chemical and IMMEDIATELY call a hospital or poison control center. Be prepared to transport the victim to a hospital if advised by a physician. If the victim is convulsing or unconscious, do not give anything by mouth, ensure that the victim's airway is open and lay the victim on his/her side with the head lower than the body. DO NOT INDUCE VOMITING. IMMEDIATELY transport the victim to a hospital. (NTP, 1992)

Nonfire Spill Response · 1 件

SMALL SPILLS AND LEAKAGE: If you spill this chemical, FIRST REMOVE ALL SOURCES OF IGNITION. Then, use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.;STORAGE PRECAUTIONS: You should store this material in a refrigerator. STORE AWAY FROM SOURCES OF IGNITION. (NTP, 1992)

Personal Protective Equipment (PPE) · 1 件

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

安全データ

毒性
mmo-sat 740 mg/plate APSXAS 17,189,80