기본 정보
- 표준 SMILES
COC(=O)C1=C(Nc2ccc(C)cc2)CC(C(=O)OC)=C(Nc2ccc(C)cc2)C1- InChIKey
ALPXOPKPVWQJMZ-UHFFFAOYSA-N- 분자식
- C24H26N2O4
- 평균 분자량
- 406.5 g/mol
- 단동위원소 질량
- 406.18925731
이름 및 식별자
- 우선 이름
- 1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis[(4-methylphenyl)amino]-, 1,4-dimethyl ester
- IUPAC
- dimethyl 2,5-bis(4-methylanilino)cyclohexa-1,4-diene-1,4-dicarboxylate
- 현지명
- 2,5-디(p-톨루이디노)-3,6-디히드로테레프탈산디메틸에스테르
- 영어명
- 2,5-Di(p-toluidino)-3,6-dihydroterephthalic acid dimethyl ester
- 분자식
- C24H26N2O4
- 분자량
- 406.48
이름 및 동의어
Dimethyl 2,5-di-p-toluidino-1,4-cyclohexadiene-1,4-dicarboxylate1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis[(4-methylphenyl)amino]-, dimethyl ester1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis((4-methylphenyl)amino)-, 1,4-dimethyl ester1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis((4-methylphenyl)amino)-, dimethyl ester1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis[(4-methylphenyl)amino]-, 1,4-dimethyl esterRefChem:41656371329-04-9SCHEMBL1415828DTXSID70723312,5-di(p-toluidino)-3,6-dihydroterephthalic acid dimethyl esterdimethyl 2,5-bis(4-methylanilino)cyclohexa-1,4-diene-1,4-dicarboxylate2,5-di-p-toluidino-3,6-dihydro-terephthalic acid dimethyl ester
이름 더 보기
2,5-디(p-톨루이디노)-3,6-디히드로테레프탈산디메틸에스테르
데이터베이스 식별자
- CAS
71329-04-9- PubChem CID
- 117114
- DTXSID
DTXSID7072331- Nikkaji
- J29.634A
물성
구조 계산 물성
- XLogP
- 5.7
- 극성 표면적
- 76.7 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 636
물리화학적 성질
- EPA
- 1 · 1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis[(4-methylphenyl)amino]-, dimethyl ester (71329-04-9)
안전 및 규제
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis[(4-methylphenyl)amino]-, 1,4-dimethyl ester: INACTIVE
관련 반응
2건
연결된 노트
불러오는 중…