기본 정보
- CAS
4158-37-6- 표준 SMILES
CCC(Cl)C#N- InChIKey
WTDNWEITCUMXGW-UHFFFAOYSA-N- 분자식
- C4H6ClN
- 평균 분자량
- 103.55 g/mol
- 단동위원소 질량
- 103.0188769
개요
Chlorobutyronitrile appears as a liquid. Practically insoluble in water (2 parts/100 parts water). Sinks in water. Vapors are heavier than air. Irritates the eyes but not to the skin. Releases hydrogen chloride, hydrogen cyanide, and hydrogen bromide gases when heated or involved in a fire.
이름 및 식별자
- 우선 이름
- 2-Chlorobutyronitrile
- IUPAC
- 2-chlorobutanenitrile
- 현지명
- 2-클로로부티로니트릴
- 영어명
- 2-chlorobutyronitrile
- 분자식
- C4H6ClN
- 분자량
- 103.55
이름 및 동의어
2-chlorobutanenitrile2-Chlorobutyronitrile4158-37-6chlorobutyronitrileEINECS 223-991-3DTXSID001035179NSC 373957RefChem:470399DTXCID601519622223-991-3Butanenitrile, 2-chloro-2-chlorbutyronitrile
이름 더 보기
2-클로로부티로니트릴
NSC373957SCHEMBL948116SCHEMBL7664681SCHEMBL11655165AKOS010963581NSC-373957CS-0251795NS00049756
데이터베이스 식별자
- CAS
4158-37-6、628-20-6- PubChem CID
- 100204
- DTXSID
DTXSID001035179- EC Number
- 223-991-3
- Nikkaji
- J224.957J
물성
구조 계산 물성
- XLogP
- 1.5
- 극성 표면적
- 23.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 6
- 형식 전하
- 0
- 복잡도
- 70.9
실험 및 물리화학적 성질
Density1.22 at 68 °F (USCG, 1999) - Denser than water; will sink
Boiling Point374 °F at 760 mmHg (USCG, 1999)
Physical Description
Chlorobutyronitrile appears as a liquid. Practically insoluble in water (2 parts/100 parts water). Sinks in water. Vapors are heavier than air. Irritates the eyes but not to the skin. Releases hydrogen chloride, hydrogen cyanide, and hydrogen bromide gases when heated or involved in a fire.
물리화학적 성질
- 끓는 점
- 144 · 144-146 °C
- 밀도
- 1.038 · 1.038±0.06 g/cm3(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, 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)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
DOT LabelPoison
Fire HazardsSpecial Hazards of Combustion Products: Toxic and irritating hydrogen cyanide, hydrogen bromide, and hydrogen chloride may form in fires. (USCG, 1999)
Health Hazards
Chemical is moderately toxic. Inhalation causes irritation of nose and throat. Ingestion causes irritation of mouth and stomach. Contact with eyes causes irritation. Can penetrate the skin on prolonged contact; only slightly irritating. (USCG, 1999)
Reactive GroupHalogenated Organic Compounds
Reactivity AlertsHighly Flammable
Reactivity ProfileCHLOROBUTYRONITRILE may attack some forms of plastics (USCG, 1999).
Air and Water ReactionsHighly flammable. Practically insoluble in water.
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
화학 및 산업
공급사5 곳
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
舟山广兴化学有限公司15698059122 15698059122 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
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