기본 정보
- CAS
1001-55-4- 표준 SMILES
CC(=O)OCC#N- InChIKey
AJEHNBIPLQJTNU-UHFFFAOYSA-N- 분자식
- C4H5NO2
- 평균 분자량
- 99.09 g/mol
- 단동위원소 질량
- 99.0320284
이름 및 식별자
- 우선 이름
- (Acetyloxy)acetonitrile
- IUPAC
- cyanomethyl acetate
- 현지명
- 아세트산시아노메틸에스테르
- 영어명
- Acetic acid cyanomethyl ester
- 분자식
- C4H5NO2
- 분자량
- 99.09
이름 및 동의어
Cyanomethyl acetate1001-55-4Acetic acid cyanomethyl esterAcetoxyacetonitrilecyanomethylacetate(ACETYLOXY)ACETONITRILE2-AcetoxyacetonitrileGlycolonitrile, acetateAcetyloxyacetonitrileGlycolonitrile, acetate (ester)Acetonitrile, (acetyloxy)-HSDB 2124
이름 더 보기
아세트산시아노메틸에스테르Acetonitrile, 2-(acetyloxy)-
VM1DZ0X2D6NSC 71942Kyanmethylester kyseliny octoveKyanmethylester kyseliny octove [Czech]BRN 1745113NSC-71942ACETOXYMETHYL CYANIDEDTXSID00142939
데이터베이스 식별자
- CAS
1001-55-4- PubChem CID
- 13843
- DTXSID
DTXSID00142939- UNII
- VM1DZ0X2D6
- EC Number
- 872-138-7
- Nikkaji
- J35.141E
물성
구조 계산 물성
- XLogP
- -0.1
- 극성 표면적
- 50.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 7
- 형식 전하
- 0
- 복잡도
- 110
실험 및 물리화학적 성질
Chemical ClassesNitrogen Compounds -> Nitriles
Vapor Pressure0.36 [mmHg]
물리화학적 성질
- 녹는점
- -22.4 °C · -22.4°C
- 끓는 점
- 185.54 °C · 185.54°C (rough estimate)
- 밀도
- 1.123 · 1.1230
- 굴절률
- 1.4166 · 1.4166 (estimate)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H227 (100%): Combustible liquid [Warning Flammable liquids]
P210, P260, P261, P262, P264, P264+P265, P270, P271, P280, P284, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P320, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P370+P378, P403, P403+P233, 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.
유해성 정보
Hazards SummaryHighly toxic by all routes; Emergency treatment: Acetonitrile; Acetonitrile can cause delayed onset (2-13 hours) cyanide poisoning; [HSDB] See NITRILES.
Hazard Classes and CategoriesFlam. Liq. 4 (100%)
안전 및 보호
Personal Protective Equipment (PPE)WHILE THERE ARE NO REPORTS OF INJURY TO HUMANS HANDLING THE MATERIAL, CARE SHOULD BE USED TO AVOID SKIN CONTACT AND INHALATION OF VAPOR, ESPECIALLY HEATED VAPOR. /METHYL CYANOACETATE/
독성 정보
Adverse EffectsOther Poison - Chemical Asphyxiant
Human Toxicity ExcerptsIT IS ABSORBED THROUGH THE SKIN, & IF NOT IMMEDIATELY REMOVED, MAY HAVE FATAL CONSEQUENCES. /GLYCOLONITRILE/
Non-Human Toxicity Excerpts
SOME TOXIC EFFECTS FOLLOWING SKIN CONTACT WERE NOTED /IN GUINEA PIGS/... /METHYL CYANOACETATE/
CYANOMETHYL ACETATE RATED 5 ON RABBIT EYES /ON A SCALE 1-10 ACCORDING TO DEGREE OF INJURY OBSERVED AFTER 24 HR, PAYING PARTICULAR ATTENTION TO CONDITION OF CORNEA. MOST SEVERE INJURY= 10/.
화학 및 산업
용도 및 제조
Uses
Used as an intermediate in the production of pharmaceuticals and as a component of synthetic resins; [HSDB]
MFR INTERMEDIATES IN PRODN OF PHARMACEUTICALS & AS COMPONENT OF SYNTHETIC RESINS /GLYCOLONITRILE/
U.S. Exports
(1977) No Data
(1979) No Data
U.S. Imports
(1977) No Data
(1979) No Data
U.S. Production
(1977) NOT PRODUCED COMMERCIALLY IN US
(1979) NOT PRODUCED COMMERCIALLY IN US
상·하류 제품 정보
하류 제품
공급사1 곳
圣克鲁斯生物技术（上海）有限公司021-60936350 · [email protected]
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