(R)-methyl 2-((tert-butoxycarbonyl)amino)-3-(4-(((trifluoromethyl)sulfonyl)oxy)phenyl)propanoate
기본 정보
- 표준 SMILES
COC(=O)[C@@H](Cc1ccc(OS(=O)(=O)C(F)(F)F)cc1)NC(=O)OC(C)(C)C- InChIKey
JZWGAKDJDOFGPF-GFCCVEGCSA-N- 분자식
- C16H20F3NO7S
- 평균 분자량
- 427.4 g/mol
- 단동위원소 질량
- 427.09125764
이름 및 식별자
- 우선 이름
- (R)-methyl 2-((tert-butoxycarbonyl)amino)-3-(4-(((trifluoromethyl)sulfonyl)oxy)phenyl)propanoate
- IUPAC
- methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate
이름 및 동의어
149709-56-8(R)-methyl 2-((tert-butoxycarbonyl)amino)-3-(4-(((trifluoromethyl)sulfonyl)oxy)phenyl)propanoateMethyl (R)-2-((tert-butoxycarbonyl)amino)-3-(4-(((trifluoromethyl)sulfonyl)oxy)phenyl)propanoateMFCD09263336D-Tyrosine, N-[(1,1-dimethylethoxy)carbonyl]-O-[(trifluoromethyl)sulfonyl]-, methyl estermethyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoatemethyl (2R)-2-(tert-butoxycarbonylamino)-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoateC16H20F3NO7SSCHEMBL7442384CS-M3314AKOS037650571CS-15007
이름 더 보기
C12963F790155methyl (R)-2-tert-butoxycarbonylamino-3-(4-trifluoromethanesulfonyloxyphenyl)propionateN-t-Butoxycarbonyl-4-trifluoro methanesulfonyloxy-D-phenylalanine methyl esterN-t-butoxycarbonyl-4-trifluoromethanesulfonyloxy-D-phenyl alanine methyl ester(R)-methyl2-((tert-butoxycarbonyl)amino)-3-(4-(((trifluoromethyl)sulfonyl)oxy)phenyl)propanoate
데이터베이스 식별자
- PubChem CID
- 53983472
물성
구조 계산 물성
- XLogP
- 2.8
- 극성 표면적
- 116 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 28
- 형식 전하
- 0
- 복잡도
- 645
관련 반응
5건
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