기본 정보
- CAS
113659-04-4- 표준 SMILES
CC1(C)CC(NC(=O)ON(Cc2ccccc2)Cc2ccccc2)CC(C)(CNC(=O)ON(Cc2ccccc2)Cc2ccccc2)C1- InChIKey
WEUNZGSETDWKHM-UHFFFAOYSA-N- 분자식
- C40H48N4O4
- 평균 분자량
- 648.8 g/mol
- 단동위원소 질량
- 648.36755602
이름 및 식별자
- 우선 이름
- Carbamic acid, N-[3-[[[[[bis(phenylmethyl)amino]oxy]carbonyl]amino]methyl]-3,5,5-trimethylcyclohexyl]-, bis(phenylmethyl)azanyl ester
- IUPAC
- (dibenzylamino) N-[3-[[(dibenzylamino)oxycarbonylamino]methyl]-3,5,5-trimethylcyclohexyl]carbamate
이름 및 동의어
Benzenemethanamine, N-((((3-(((((bis(phenylmethyl)amino)oxy)carbonyl)amino)methyl)-3,5,5-trimethylcyclohexyl)amino)carbonyl)oxy)-N-(phenylmethyl)-DTXSID20888862Carbamic acid, N-(3-(((((bis(phenylmethyl)amino)oxy)carbonyl)amino)methyl)-3,5,5-trimethylcyclohexyl)-, bis(phenylmethyl)azanyl esterBenzenemethanamine, N-[[[[3-[[[[[bis(phenylmethyl)amino]oxy]carbonyl]amino]methyl]-3,5,5-trimethylcyclohexyl]amino]carbonyl]oxy]-N-(phenylmethyl)-Carbamic acid, N-[3-[[[[[bis(phenylmethyl)amino]oxy]carbonyl]amino]methyl]-3,5,5-trimethylcyclohexyl]-, bis(phenylmethyl)azanyl esterRefChem:574036DTXCID301028133113659-04-4SCHEMBL9762827[(Dibenzylamino)oxy]({3-[({[(dibenzylamino)oxy]carbonyl}amino)methyl]-3,5,5-trimethylcyclohexyl}amino)methanone1-{N-[O-(N,N-dibenzylamino)carboxy]amino}-3-{N-[O-(N,N-dibenzylamino)carboxy]amino}methyl-3,5,5-trimethylcyclohexane
데이터베이스 식별자
- CAS
113659-04-4- PubChem CID
- 15180716
- DTXSID
DTXSID20888862
물성
구조 계산 물성
- XLogP
- 8.9
- 극성 표면적
- 83.1 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 15
- 무거운 원자 수
- 48
- 형식 전하
- 0
- 복잡도
- 928
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
화학 및 산업
용도 및 제조
General Manufacturing InformationCarbamic acid, N-[3-[[[[[bis(phenylmethyl)amino]oxy]carbonyl]amino]methyl]-3,5,5-trimethylcyclohexyl]-, bis(phenylmethyl)azanyl ester: INACTIVE
관련 반응
2건
화합물 노트
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