2-ニトロビフェニル

2-Nitrobiphenyl

HCID 6829CAS 86-00-0

基本情報

標準SMILES
O=[N+]([O-])c1ccccc1-c1ccccc1
InChIKey
YOJKKXRJMXIKSR-UHFFFAOYSA-N
分子式
C12H9NO2
平均分子量
199.2 g/mol
単同位体質量
199.06332853

名称と識別子

優先名称
2-Nitrobiphenyl
IUPAC
1-nitro-2-phenylbenzene
現地名
2-ニトロビフェニル
英語名
2-Nitrobiphenyl
分子式
C12H9NO2
分子量
199.21

名称と別名

2-Nitrobiphenyl2-Nitrodiphenyl2-Nitro-1,1'-biphenylO-NITROBIPHENYL2'-NitrobiphenylCCRIS 962DTXSID9025746NSC 5532EINECS 201-646-8UNII-8R1N47E4DTCP 3688R1N47E4DT
名称をさらに表示
2-ニトロビフェニルニトロビフェニルo-ニトロジフェニル2-ニトロジフェニル2-ニトロ-1,1'-ビフェニル2-ニトロビフェニル標準品2‐ニトロビフェニル2‐ニトロビフェニル標準品2-ニトロ-1,1′-ビフェニル2-フェニル-1-ニトロベンゼンOnbcp368Nitrodiphenyl2-NitrobiphneylO-NITRODIPHENYL2-nitro-bipheny
AI3-02563NSC-5532O-NITROBIPHENYL [MI]DTXCID505746oNitrobiphenyloNitrodiphenyl2NitrodiphenylBiphenyl, 2nitro

データベース識別子

CAS
86-00-0
PubChem CID
6829
DTXSID
DTXSID9025746
ChEMBL
CHEMBL1391678
UNII
8R1N47E4DT
EC Number
201-646-8
Nikkaji
J3.892J

物性

構造計算による物性

XLogP
3.7
極性表面積
45.8 Ų
水素結合供与体数
0
水素結合受容体数
2
回転可能結合数
1
重原子数
15

実験および物理化学的性質

Density1.203 at 77 °F (NTP, 1992) - Denser than water; will sink
Solubilityless than 1 mg/mL at 72 °F (NTP, 1992)
Flash Point290 °F (NTP, 1992)
Boiling Point608 °F at 760 mmHg (NTP, 1992)
Melting Point97 to 100 °F (NTP, 1992)
Vapor Density5.9 (NTP, 1992) - Heavier than air; will sink (Relative to Air)

物理化学的性質

融点
36 · 36-38 °C(lit.)
沸点
320 °C · 320 °C
比重(密度)
1.44 · 1.44
蒸気密度
5.9 · 5.9 (vs air)
蒸気圧
2 mm · 2 mm Hg ( 140 °C)
屈折率
1.613 · 1.613-1.615

化学的性質

化学的特性Clear yellow liquid after melting. Insoluble in water, soluble in methanol, ethanol, acetone, dimethylformamide, and tetrahydrofurfuryl alcohol.

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (97.5%): Harmful in contact with skin [Warning Acute toxicity, dermal];H332 (97.5%): Harmful if inhaled [Warning Acute toxicity, inhalation];H351 (97.5%): Suspected of causing cancer [Warning Carcinogenicity]

P203, P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P318, P321, P330, P362+P364, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Fire HazardsThis compound is combustible. (NTP, 1992)
Hazards SummaryCauses coma, dyspnea, and weight loss in oral lethal-dose studies of rats and rabbits; [RTECS] May cause irritation; Harmful by ingestion, inhalation, and skin absorption; Suspected carcinogen; [Sigma-Aldrich MSDS] See 4-Nitrobiphenyl.
Reactive GroupHydrocarbons, Aromatic;Nitro, Nitroso, Nitrate, and Nitrite Compounds, Organic
Reactivity Profile · 1 件

Aromatic nitro compounds, such as 2-NITRO-1,1'-BIPHENYL, range from slight to strong oxidizing agents. If mixed with reducing agents, including hydrides, sulfides and nitrides, they may begin a vigorous reaction that culminates in a detonation. The aromatic nitro compounds may explode in the presence of a base such as sodium hydroxide or potassium hydroxide even in the presence of water or organic solvents. The explosive tendencies of aromatic nitro compounds are increased by the presence of multiple nitro groups.

Air and Water ReactionsInsoluble in water.
Hazard Classes and CategoriesAcute Tox. 4 (100%);Acute Tox. 4 (97.5%);Acute Tox. 4 (97.5%);Carc. 2 (97.5%)

安全と保護具

Fire FightingFires involving this compound can be controlled using 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: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with 60-70% ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 60-70% ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, 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. (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

wgk
3
rtecs
DV5530000
hs_code
2904.20.5000
risk_code
20/21/22-40-68-22
hazard_code
Xn
safety_code
2-7-36-45-36/37

化学と産業

用途と製造

Uses · 2 件

Used as a plasticizer for resins, cellulose acetate and nitrate, and polystyrenes, as a fungicide for textiles, wood preservative, and dye intermediate; [Merck Index]

Applying Wood Preservatives [Category: Other];Textiles (Printing, Dyeing, or Finishing) [Category: Industry]

応用分野 · 3 件

用途有機合成原料。合成樹脂可塑剤。

使用2-Nitrobiphenyl is used as a plasticizer for resins, cellulose acetate, cellulose nitrate, and polystyrenes; as a fungicide for textiles; as a wood preservative; and as a dye intermediate.

一般的な説明Gold to tan crystals or brown solid.

調製方法

純化方法Crystallise it from EtOH (seeding required). Sublime it under vacuum. [Beilstein 5 H 582, 5 I 273, 5 II 487, 5 III 1750.]

サプライヤー50 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]

関連反応

22 件

関連ノート

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