基本情報
- CAS
592-34-7- 標準SMILES
CCCCOC(=O)Cl- InChIKey
NRDQFWXVTPZZAZ-UHFFFAOYSA-N- 分子式
- C5H9ClO2
- 平均分子量
- 136.58 g/mol
- 単同位体質量
- 136.02910721
概要
N-butyl chloroformate appears as a colorless liquid. Flash point near 70 °F. Very toxic by inhalation. Denser than water. Used to make other chemicals.
名称と識別子
- 優先名称
- Butyl chloroformate
- IUPAC
- butyl carbonochloridate
- 現地名
- クロロぎ酸ブチル
- 英語名
- Butyl chloroformate
- 分子式
- C5H9ClO2
- 分子量
- 136.58
名称と別名
名称をさらに表示
データベース識別子
- CAS
592-34-7- PubChem CID
- 61140
- DTXSID
DTXSID7060461- UNII
- 3TGX130CB0
- EC Number
- 209-750-5
- Nikkaji
- J95.611B
物性
構造計算による物性
- XLogP
- 2.8
- 極性表面積
- 26.3 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
- 4
- 重原子数
- 8
- 形式電荷
- 0
- 複雑度
- 72.8
実験および物理化学的性質
Chemical Classes
Toxic Gases & Vapors -> Acid Halides
Corrosives
Density
1.0513 at 68 °F (USCG, 1999) - Denser than water; will sink
1.06 g/cm³
Relative density of the vapour/air-mixture at 20 °C (air = 1): 1.02
1.074 @25 °C
Flash Point
77 °F (USCG, 1999)
77 °F
30 °C c.c.
Boiling Point
280.4 °F at 760 mmHg (USCG, 1999)
138-145 °C
142 °C @760 [mm Hg]
Vapor Pressure
5.4 [mmHg]
Vapor pressure, kPa at 20 °C: 0.72
Physical Description
N-butyl chloroformate appears as a colorless liquid. Flash point near 70 °F. Very toxic by inhalation. Denser than water. Used to make other chemicals.
Liquid
A colorless liquid; [CAMEO]
COLOURLESS LIQUID WITH PUNGENT ODOUR.
物理化学的性質
- 融点
- -70 °C · -70 °C
- 沸点
- 142 °C · 142 °C(lit.)
- 比重(密度)
- 1.074 g/mL · 1.074 g/mL at 25 °C(lit.)
- 蒸気圧
- 2.42 psi · 2.42 psi ( 20 °C)
- 屈折率
- 20 · n20/D 1.412(lit.)
- 闪点
- 77 °F · 77 °F
- 貯蔵温度
- 2 · 2-8°C
- 外見
- 液体
- 色
- クリア
- 水溶解度
- 分解する
- BRN
- 605635 · 605635
- LogP
- 1.895 · 1.895 (est)
- CAS データベース
- 592 · 592-34-7(CAS DataBase Reference)
- NISTの化学物質情報
- Carbonochloridic acid, butyl ester(592-34-7)
- EPAの化学物質情報
- n-Butyl chloroformate (592-34-7)
化学的性質
化学的特性clear liquid
安全と法規制
GHS分類
GHS Classification
Danger
H226: Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P284, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P320, P321, P330, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
危険有害性情報
Regulatory Information
Chemical: Carbonochloridic acid, butyl ester
Carbonochloridic acid, butyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Carbonochloridic acid, butyl ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 14-11-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/10341
Butylchloroformate: Does not have an individual approval but may be used under an appropriate group standard
The 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.)
Fire Hazards
Special Hazards of Combustion Products: Irritating and toxic hydrogen chloride and phosgene may be formed.
· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.
Flammable. Gives off irritating or toxic fumes (or gases) in a fire. Above 30 °C explosive vapour/air mixtures may be formed.
Health Hazards
Inhalation of vapor irritates nose and throat and can cause delayed pulmonary edema. Liquid irritates eyes and causes severe skin burns and irreversible skin damage if allowed to remain. Can cause blindness. Ingestion causes burns of mouth and stomach. (USCG, 1999)
· TOXIC and/or CORROSIVE; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death.
Hazards Summary
A skin, eye, and respiratory tract irritant; May cause pulmonary edema and burns to the eyes and skin; [ICSC] A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause chemical pneumonitis; [MSDSonline] See CHLOROFORMATES.
安全と保護具
Fire Fighting
Excerpt from ERG Guide 155 [Substances - Toxic and/or Corrosive (Flammable / Water-Sensitive)]:
NO water. Use dry powder, carbon dioxide, alcohol-resistant foam. In case of fire: keep drums, etc., cool by spraying with water. NO direct contact with water.
First Aid Measures
Fresh air, rest. Half-upright position. Artificial respiration may be needed. Refer for medical attention.
Remove contaminated clothes. Rinse skin with plenty of water or shower. Refer for medical attention .
First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.
Rinse mouth. Do NOT induce vomiting. Give one or two glasses of water to drink. Refer for medical attention .
Accidental Release Measures
· 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
INHALATION: Remove victim from exposure; if breathing stops, administer artificial respiration; If breathing is difficult, give oxygen; call physician.
General First Aid:
Exposure Control and Personal Protection
· Wear positive pressure self-contained breathing apparatus (SCBA).
TIH (Toxic Inhalation Hazard) - Term used to describe gases and volatile liquids that are toxic when inhaled. Some are TIH materials themselves, e.g., chlorine, and some release TIH gases when spilled in water, e.g., chlorosilanes. [ERG 2016].
0.2 [ppm]
Spillage Disposal
Evacuate danger area! Consult an expert! Personal protection: chemical protection suit including self-contained breathing apparatus. Do NOT let this chemical enter the environment. Collect leaking and spilled liquid in sealable dry plastic containers as far as possible. Absorb remaining liquid in dry sand or inert absorbent. Then store and dispose of according to local regulations.
Isolation and Evacuation
Excerpt from ERG Guide 155 [Substances - Toxic and/or Corrosive (Flammable / Water-Sensitive)]:
Immediate precautionary measure
Small spill:
Small spill:
毒性情報
Signs and Symptoms
Sore throat. Burning sensation. Cough. Laboured breathing. Shortness of breath. Symptoms may be delayed.
Redness. Pain. Skin burns.
Redness. Pain. Severe deep burns.
Abdominal pain. Burning sensation. Shock or collapse.
安全データ
- F
- 10-19
- wgk
- 1
- tsca
- TSCA listed
- ridadr
- UN 2743
- hs_code
- 29159020
- risk_code
- 10-23-34
- 化審法
- (2)-1704
- 消防法
- 危-4-2-III
- hazard_code
- T
- safety_code
- 26-36-45
- hazard_class
- 6.1
- packing_group
- II
化学と産業
用途と製造
General Manufacturing Information
Oil and Gas Drilling, Extraction, and Support activities
Carbonochloridic acid, butyl ester: ACTIVE
応用分野
一般的な説明A colorless liquid. Flash point near 70°F. Very toxic by inhalation. Denser than water. Used to make other chemicals.
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