기본 정보
- CAS
68227-98-5- 표준 SMILES
C=CC(=O)OCCCCN(C)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
JLUHIZCVSXFBEG-UHFFFAOYSA-N- 분자식
- C14H14F13NO4S
- 평균 분자량
- 539.31 g/mol
- 단동위원소 질량
- 539.0435952
개요
See other relationships...
이름 및 식별자
- 우선 이름
- 2-Propenoic acid, 4-(methyl((1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)sulfonyl)amino)butyl ester
- IUPAC
- 4-[methyl(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]butyl prop-2-enoate
- 현지명
- 4-[메틸[(트리데카플루오로헥실)술포닐]아미노]부틸아크릴레이트
- 영어명
- 4-[methyl[(tridecafluorohexyl)sulphonyl]amino]butyl acrylate
- 분자식
- C14H14F13NO4S
- 분자량
- 539.31
이름 및 동의어
EINECS 269-394-14-(((Tridecafluorohexyl)sulfonyl)methylamino)butyl 2-propenoate2-Propenoic acid, 4-(methyl((1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)sulfonyl)amino)butyl ester2-Propenoic acid, 4-[methyl[(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)sulfonyl]amino]butyl esterRefChem:48209568227-98-52-Propenoic acid, 4-[methyl[(tridecafluorohexyl)sulfonyl]amino]butyl ester2-Propenoic acid, 4-(methyl((tridecafluorohexyl)sulfonyl)amino)butyl esterDTXSID80713024-(Methyl((tridecafluorohexyl)sulphonyl)amino)butyl acrylateNS000112234-(Methyl((tridecafluorohexyl)sulfonyl)amino)butyl 2-propenoate
이름 더 보기
4-[메틸[(트리데카플루오로헥실)술포닐]아미노]부틸아크릴레이트4-[methyl[(tridecafluorohexyl)sulphonyl]amino]butyl acrylate2-Propenoic acid, 4-methyl(tridecafluorohexyl)sulfonylaminobutyl esterPropenoic acid 4-[methyl[(tridecafluorohexyl)sulfonyl]amino]butyl ester
4-(1,1,2,2,3,3,4,4,5,5,6,6,6-Tridecafluoro-N-methylhexane-1-sulfonamido)butyl prop-2-enoate
물성
구조 계산 물성
- XLogP
- 5.3
- 극성 표면적
- 72.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 18
- 회전 가능 결합 수
- 13
- 무거운 원자 수
- 33
- 형식 전하
- 0
- 복잡도
- 818
실험 및 물리화학적 성질
PFAS
PFAS -> Other/unspecified
PFAS -> Other/unspecified
PFAS -> OECD Category
PFAS -> Other/unspecified
물리화학적 성질
- EPA
- 2 · 2-Propenoic acid, 4-[methyl[(tridecafluorohexyl)sulfonyl]amino]butyl ester (68227-98-5)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory Information
S - indicates a substance that is identified in a final Significant New Use Rule.
Substance: 4-[methyl[(tridecafluorohexyl)sulphonyl]amino]butyl acrylate
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing Information2-Propenoic acid, 4-[methyl[(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)sulfonyl]amino]butyl ester: INACTIVE
공급사1 곳
Portail Substances Chimiques[email protected]
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