기본 정보
- CAS
68975-78-0- 표준 SMILES
CC1=NC(C)CN1C(=O)NCC1(C)CC(NC(=O)N2CC(C)N=C2C)CC(C)(C)C1- InChIKey
AERVMEVXZLZSML-UHFFFAOYSA-N- 분자식
- C22H38N6O2
- 평균 분자량
- 418.6 g/mol
- 단동위원소 질량
- 418.30562448
이름 및 식별자
- 우선 이름
- 1H-Imidazole-1-carboxamide, N-[3-[[[(4,5-dihydro-2,4-dimethyl-1H-imidazol-1-yl)carbonyl]amino]methyl]-3,5,5-trimethylcyclohexyl]-4,5-dihydro-2,4-dimethyl-
- IUPAC
- N-[[5-[(2,4-dimethyl-4,5-dihydroimidazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl]methyl]-2,4-dimethyl-4,5-dihydroimidazole-1-carboxamide
- 영어명
- N-[3-[[[(4,5-dihydro-2,4-dimethyl-1H-imidazol-1-yl)carbonyl]amino]methyl]-3,5,5-trimethylcyclohexyl]-4,5-dihydro-2,4-dimethyl-1H-imidazole-1-carboxamide
- 분자식
- C22H38N6O2
- 분자량
- 418.58
이름 및 동의어
EINECS 273-476-21H-Imidazole-1-carboxamide, N-[3-[[[(4,5-dihydro-2,4-dimethyl-1H-imidazol-1-yl)carbonyl]amino]methyl]-3,5,5-trimethylcyclohexyl]-4,5-dihydro-2,4-dimethyl-DTXSID608876371-((2,4-Dimethyl-2-imidazolin-1-yl)carbonylaminomethyl)-3-((2,4-dimethyl-2-imidazolin-1-yl)carbonylamino)-1,5,5-trimethylcyclohexane1H-Imidazole-1-carboxamide, N-(3-((((4,5-dihydro-2,4-dimethyl-1H-imidazol-1-yl)carbonyl)amino)methyl)-3,5,5-trimethylcyclohexyl)-4,5-dihydro-2,4-dimethyl-N-[3-[[[(4,5-DIHYDRO-2,4-DIMETHYL-1H-IMIDAZOL-1-YL)CARBONYL]AMINO]METHYL]-3,5,5-TRIMETHYLCYCLOHEXYL]-4,5-DIHYDRO-2,4-DIMETHYL-1H-IMIDAZOLE-1-CARBOXAMIDEN-(3-((((4,5-Dihydro-2,4-dimethyl-1H-imidazol-1-yl)carbonyl)amino)methyl)-3,5,5-trimethylcyclohexyl)-4,5-dihydro-2,4-dimethyl-1H-imidazole-1-carboxamideRefChem:238162DTXCID301026925273-476-268975-78-0HV26E3K6YP
이름 더 보기
N-[3-[[[[(4,5-Dihydro-2,4-dimethyl-1H-imidazol)-1-yl]carbonyl]amino]methyl]-3,5,5-trimethylcyclohexyl]-4,5-dihydro-2,4-dimethyl-1H-imidazole-1-carboxamide
물성
구조 계산 물성
- XLogP
- 1.4
- 극성 표면적
- 89.4 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 761
물리화학적 성질
- 밀도
- 1.22 · 1.22±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 12.98 · 12.98±0.60(Predicted)
- EPA
- 1 H-Imidazole-1-carboxamide, · 1H-Imidazole-1-carboxamide, N-[3-[[[(4,5-dihydro-2,4-dimethyl-1H-imidazol-1-yl)carbonyl]amino]methyl]-3,5,5-trimethylcyclohexyl]-4,5-dihydro-2,4-dimethyl- (68975-78-0)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information1H-Imidazole-1-carboxamide, N-[3-[[[(4,5-dihydro-2,4-dimethyl-1H-imidazol-1-yl)carbonyl]amino]methyl]-3,5,5-trimethylcyclohexyl]-4,5-dihydro-2,4-dimethyl-: INACTIVE
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