기본 정보
- 표준 SMILES
O=C(Cl)OCCl- InChIKey
JYWJULGYGOLCGW-UHFFFAOYSA-N- 분자식
- C2H2Cl2O2
- 평균 분자량
- 128.94 g/mol
- 단동위원소 질량
- 127.94318466
개요
Chloromethyl chloroformate appears as a colorless liquid with a penetrating, irritating odor. Denser than water. Contact may irritate skin, eyes and mucous membranes. Toxic by ingestion, inhalation and skin absorption. Used to make other chemicals.
이름 및 식별자
- 우선 이름
- Chloromethyl chloroformate
- IUPAC
- chloromethyl carbonochloridate
- 현지명
- 클로로포름산메틸에스테르
- 영어명
- Chloromethyl chloroformate
- 분자식
- C2H2Cl2O2
- 분자량
- 128.94
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
22128-62-7- PubChem CID
- 62754
- DTXSID
DTXSID9074567- UNII
- V6LT723843
- EC Number
- 244-793-3
- Nikkaji
- J26.283H
물성
구조 계산 물성
- XLogP
- 1.9
- 극성 표면적
- 26.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 6
- 형식 전하
- 0
- 복잡도
- 53.5
실험 및 물리화학적 성질
Physical Description
Chloromethyl chloroformate appears as a colorless liquid with a penetrating, irritating odor. Denser than water. Contact may irritate skin, eyes and mucous membranes. Toxic by ingestion, inhalation and skin absorption. Used to make other chemicals.
물리화학적 성질
- 녹는점
- -20 °C · <-20°C
- 끓는 점
- 107 · 107-108 °C(lit.)
- 밀도
- 1.449 g/mL · 1.449 g/mL at 20 °C
- 굴절률
- 20 · n20/D 1.428
- 인화점
- 95 °C · 95°C
- 저장 조건
- 2 · 2-8°C
- 용해도
- 클로로포름, 메탄올(약간)에 용해됨
- 물리적 상태
- 투명한 액체
- 색상
- Colorless to Light yellow to Light orange
- 수용성
- 물과 약간 섞임.
- BRN
- 506426 · 506426
- 안정성
- 매우 습기에 민감하고 흡습성
- InChI
- 1S/C2H2Cl2O2/c3-1-6-2(4)5/h1H2
- InChIKey
- JYWJULGYGOLCGW-UHFFFAOYSA-N
- SMILES
- ClCOC(Cl)=O
- EPA
- Carbonochloridic acid, chloromethyl ester (22128-62-7)
화학적 성질
Chloromethyl chloroformate is Clear Colourless Oil
안전 및 규제
GHS 분류
GHS Classification
Danger
H302 (11.8%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 51 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Fire Hazards
Excerpt from ERG Guide 157 [Substances - Toxic and/or Corrosive (Non-Combustible / Water-Sensitive)]:
· Non-combustible, substance itself does not burn but may decompose upon heating to produce corrosive and/or toxic fumes.
Health Hazards
Excerpt from ERG Guide 157 [Substances - Toxic and/or Corrosive (Non-Combustible / Water-Sensitive)]:
· TOXIC and/or CORROSIVE; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death.
Reactivity Profile
CHLOROMETHYL CHLOROFORMATE is water reactive. Incompatible with strong oxidizing agents, alcohols, bases (including amines). May react vigorously or explosively if mixed with diisopropyl ether or other ethers in the presence of trace amounts of metal salts [J. Haz. Mat., 1981, 4, 291].
DOT Hazard Classification
Chloromethyl chloroformate
UN2745
Div 6.1 Poisonous materials (49 eCFR § 173.132)
Div 6.1 Poisonous materials (49 eCFR § 173.132)
PG II: the degree of danger presented by the material is medium
Hazard Classes and Categories
Acute Tox. 4 (11.8%)
Corrosives, Reactive agents - 1st degree
안전 및 보호
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
Excerpt from ERG Guide 157 [Substances - Toxic and/or Corrosive (Non-Combustible / Water-Sensitive)]:
General First Aid:
Isolation and Evacuation
Excerpt from ERG Guide 157 [Substances - Toxic and/or Corrosive (Non-Combustible / Water-Sensitive)]:
Immediate precautionary measure
안전 데이터
- wgk
- 3
- ridadr
- UN 2745
- HS 번호
- 2915.90.5050
- risk_code
- 23-34
- hazard_code
- T
- safety_code
- 26-36/37/39-45
- 포장분류
- II
- 위험 등급
- 6.1
- F 고인화성물질
- 10-19-21
- Hazard Classifications
- Acute Tox. 3 InhalationSkin Corr. 1B
- 스토리지 클래스
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
화학 및 산업
응용 분야
용도Chloromethyl chloroformate is used as a reagent in the synthesis of carbamates and carbonates.
일반 설명Chloromethyl chloroformate is a colorless liquid with a penetrating, irritating odor. Denser than water. Contact may irritate skin, eyes and mucous membranes. Toxic by ingestion, inhalation and skin absorption. Used to make other chemicals.
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