기본 정보
- CAS
1357354-55-2- 표준 SMILES
CN(C(=O)OC(C)(C)C)C1CCC(C(=O)O)CC1- InChIKey
IJTQIFFGXVRWSA-UHFFFAOYSA-N- 분자식
- C13H23NO4
- 평균 분자량
- 257.33 g/mol
이름 및 식별자
- 우선 이름
- 4-(tert-Butoxycarbonyl-methyl-amino)-cyclohexanecarboxylic acid
- IUPAC
- 4-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]cyclohexane-1-carboxylic acid
- 영어명
- 4-(Tert-Butoxycarbonyl-Methyl-Amino)-Cyclohexanecarboxylic Acid
- 분자식
- C13H23NO4
- 분자량
- 257.33
이름 및 동의어
609805-41-61357354-55-24-(tert-Butoxycarbonyl-methyl-amino)-cyclohexanecarboxylic acidtrans-4-[N-Methyl-N-(tert-butoxycarbonyl)-amino]cyclohexanecarboxylic acid4-((tert-Butoxycarbonyl)(methyl)amino)cyclohexanecarboxylic acidMFCD23726560trans-4-[tert-Butoxycarbonyl(methyl)amino]cyclohexanecarboxylic acidMFCD28383642trans-4-((tert-Butoxycarbonyl)(methyl)amino)cyclohexane-1-carboxylic acidtrans-4-[N-Methyl-N-(tert-butoxycarbonyl)amino]cyclohexanecarboxylic acid4-(N-Boc-N-methylamino)cyclohexanecarboxylic Acid4-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]cyclohexane-1-carboxylic acid
이름 더 보기
4-((tert-butoxycarbonyl)(methyl)amino)cyclohexane-1-carboxylic acid4-[[(1,1-Dimethylethoxy)carbonyl]methylamino]cyclohexanecarboxylic acid4-(Tert-Butoxycarbonyl-Methyl-Amino)-Cyclohexanecarboxylic Acid(WX610231)Cyclohexanecarboxylic acid, 4-[[(1,1-dimethylethoxy)carbonyl]methylamino]-
cis-4-[{[(1,1-dimethylethyl)oxy]carbonyl}(methyl)amino)cyclohexanecarboxylic acidcis-4-[{[(1,1-dimethylethyl)oxy]carbonyl}(methyl)amino]cyclohexanecarboxylic acidSCHEMBL1299111SCHEMBL1299115SCHEMBL1344888IJTQIFFGXVRWSA-AOOOYVTPSA-NIJTQIFFGXVRWSA-MGCOHNPYSA-NAT35230
데이터베이스 식별자
- CAS
1357354-55-2
물성
구조 계산 물성
- XLogP
- 1.9
- 극성 표면적
- 66.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 313
물리화학적 성질
- 끓는 점
- 375.025 · 375.025±31.00 °C(Press: 760.00 Torr)(predicted)
- 밀도
- 1.116 · 1.116±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- 산도 계수 (pKa)
- 4.761 · 4.761±0.10(predicted)
화학 및 산업
공급사8 곳
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江苏药泽医药科技有限公司18550739526 · [email protected]
湖北骓慕医药科技有限公司17362621266 · [email protected]
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