(S)-N-메틸-1-[3,5-비스(트리플루오로메틸)페닐]에틸아민
(S)-N-Methyl-1-[3,5-bis(trifluoromethyl)phenyl]ethylamine
기본 정보
- CAS
511256-36-3- 표준 SMILES
CN[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1- InChIKey
ZHIAARPZLAPMHX-LURJTMIESA-N- 분자식
- C11H11F6N
- 평균 분자량
- 271.2 g/mol
- 단동위원소 질량
- 271.07956833
이름 및 식별자
- 우선 이름
- (S)-N-Methyl-1-[3,5-bis(trifluoromethyl)phenyl]ethylamine
- IUPAC
- (1S)-1-[3,5-bis(trifluoromethyl)phenyl]-N-methylethanamine
- 현지명
- (S)-N-메틸-1-[3,5-비스(트리플루오로메틸)페닐]에틸아민
- 영어명
- (S)-N-Methyl-1-[3,5-bis(trifluoromethyl)phenyl]ethylamine
- 분자식
- C11H11F6N
- 분자량
- 271.2
이름 및 동의어
511256-36-3(S)-N-Methyl-1-[3,5-bis(trifluoromethyl)phenyl]ethylamine(S)-1-(3,5-bis(trifluoromethyl)phenyl)-N-methylethanamineMFCD07779108(1S)-1-[3,5-bis(trifluoromethyl)phenyl]-N-methylethanamine[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl](methyl)amineC11H11F6N(S)-1-[3,5-Bis(trifluoromethyl)phenyl]-N-methylethanamine(1S)-1-[3,5-bis(trifluoromethyl)phenyl]-N-methyl-ethanamineSCHEMBL3154962DTXSID40469394AKOS015850627
이름 더 보기
(S)-N-메틸-1-[3,5-비스(트리플루오로메틸)페닐]에틸아민S-NME-MBT-PEM(S)-N-METHYL-1-[BIS-3,5-(TRIFLUOROMETHYL)PHENYL]ETHYLAMINE(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl](methyl)amine(αS)-N,α-Dimethyl-3,5-bis(trifluoromethyl)benzenemethanamine(S)-1-(3,5-bis(trifluoromethyl)phenyl)-N-methylethan-1-amineBenzenemethanamine, N,α-dimethyl-3,5-bis(trifluoromethyl)-, (αS)-
PS-7279SY533101CS-0180969[(S)-1-(3,5-bis-trifluoromethyl-phenyl)-ethyl]-methyl-amine(1S)-1-[3,5-Bis(trifluoromethyl)phenyl]-N-methylethan-1-amine
데이터베이스 식별자
- CAS
511256-36-3- PubChem CID
- 11608744
- DTXSID
DTXSID40469394
물성
구조 계산 물성
- XLogP
- 3.5
- 극성 표면적
- 12 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 250
물리화학적 성질
- 끓는 점
- 172.9 · 172.9±35.0 °C(Predicted)
- 밀도
- 1.259 · 1.259±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 8.93 · 8.93±0.10(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- HS 번호
- 2921490090
- hazard_code
- Xi
- 위험 참고 사항
- Irritant
관련 반응
3건
화합물 노트
불러오는 중…