기본 정보
- CAS
175221-03-1- 표준 SMILES
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)[C@H]1C[C@@H]1C(=O)O- InChIKey
ZJAOAVRRNBJCLX-QNWJLWSRSA-N- 분자식
- C15H24O4
- 평균 분자량
- 268.35 g/mol
- 단동위원소 질량
- 268.16745924
이름 및 식별자
- 우선 이름
- (1S,2S)-2-(((1R,2S,5R)-2-isopropyl-5-methylcyclohexyloxy)carbonyl)cyclopropanecarboxylic acid
- IUPAC
- trans-(1S,2S)-2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxycarbonylcyclopropane-1-carboxylic acid
- 영어명
- (1S,2S)-2-(((1R,2S,5R)-2-isopropyl-5-Methylcyclohexyloxy)carbonyl)cyclopropanecarboxylic acid
- 분자식
- C15H24O4
- 분자량
- 268.35
이름 및 동의어
175221-03-1(1S,2S)-2-(((1R,2S,5R)-2-isopropyl-5-methylcyclohexyloxy)carbonyl)cyclopropanecarboxylic acid(1S,2S)-Cyclopropane-1,2-dicarboxylic Acid Monomenthyl Ester(1S,2S)-2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxycarbonylcyclopropane-1-carboxylic acid(1S,2S)-2-((((1R,2S,5R)-2-isopropyl-5-methylcyclohexyl)oxy)carbonyl)cyclopropanecarboxylic acid(1S,2S)-2-({[(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl]oxy}carbonyl)cyclopropane-1-carboxylic acidSCHEMBL20559002CS-M0130MFCD18206963AKOS037650060CS-14185DB-246751
이름 더 보기
F788496(1S,2S)-2-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]carbonylcyclopropanecarboxylic acid(1S,2S)-2-((((1R,2S,5R)-2-isopropyl-5-methylcyclohexyl)oxy)carbonyl)cyclopropane-1-carboxylic acid(1S,2S)-2-(((1R,2S,5R)-2-isopropyl-5-Methylcyclohexyloxy)carbonyl)cyclopropanecarboxylic acid-5(1S,2S)-2-(((1R,2S,5R)-2-isopropyl-5-methylcyclohexyloxy)carbonyl)cyclopropanecarboxylicacid1,2-Cyclopropanedicarboxylic acid, 1-[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl] ester, (1S,2S)-W95
물성
구조 계산 물성
- XLogP
- 3.2
- 극성 표면적
- 63.6 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 363
물리화학적 성질
- 끓는 점
- 379.3 · 379.3±35.0 °C(Predicted)
- 밀도
- 1.11 · 1.11±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 4.07 · 4.07±0.11(Predicted)
화학 및 산업
응용 분야
용도(1S,2S)-Cyclopropane-1,2-dicarboxylic Acid Monomenthyl Ester was used in the synthetic preparation of Callipeltoside A, a compound that exerts cytotoxicity again human bronchopulmonary non-small cell lung carcinoma.
상·하류 제품 정보
상류 원료
공급사8 곳
台州南峰药物研究所[email protected] 13127117265 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 18917919676 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
上海皓元医药股份有限公司021-58950125 · [email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…