기본 정보
- 표준 SMILES
Cc1c(C)c2c(c(C)c1OC(=O)c1ccc(CCC(Br)CBr)cn1)CCC(C)(CCCC(C)CCCC(C)CCCC(C)C)O2- InChIKey
YCWMFCFXBWLYPH-UHFFFAOYSA-N- 분자식
- C39H59Br2NO3
- 평균 분자량
- 749.7 g/mol
- 단동위원소 질량
- 747.28616895
이름 및 식별자
- 우선 이름
- 2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-yl 5-(3,4-dibromobutyl)pyridine-2-carboxylate
- IUPAC
- [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] 5-(3,4-dibromobutyl)pyridine-2-carboxylate
- 영어명
- [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl] 5-(3,4- dibromobutyl)pyridine-2-carboxylate
- 분자식
- C39H59Br2NO3
- 분자량
- 749.7
이름 및 동의어
85446-72-6DTXSID2010059722,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-yl 5-(3,4-dibromobutyl)pyridine-2-carboxylateRefChem:1060003DTXCID601432848dl-alpha-Tocopheryl 5-(3,4-dibromobutyl)picolinate2-Pyridinecarboxylic acid, 5-(3,4-dibromobutyl)-, 3,4-dihydro-2,5-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl esterYCWMFCFXBWLYPH-UHFFFAOYSA-N[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl] 5-(3,4- dibromobutyl)pyridine-2-carboxylate2-Pyridinecarboxylic acid, 5-(3,4-dibromobutyl)-, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl ester
데이터베이스 식별자
- CAS
85446-72-6- PubChem CID
- 3069868
- DTXSID
DTXSID201005972
물성
구조 계산 물성
- XLogP
- 13.9
- 극성 표면적
- 48.4 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 19
- 무거운 원자 수
- 45
- 형식 전하
- 0
- 복잡도
- 856
화학 및 산업
공급사1 곳
HONEST JOY HOLDINGS LIMITED[email protected]
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