1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis((4-chlorophenyl)amino)-, 1,4-dimethyl ester

HCID 14745935CAS 71329-03-8

기본 정보

표준 SMILES
COC(=O)C1=C(Nc2ccc(Cl)cc2)CC(C(=O)OC)=C(Nc2ccc(Cl)cc2)C1
InChIKey
PODOFHKXOOHXSI-UHFFFAOYSA-N
분자식
C22H20Cl2N2O4
평균 분자량
447.3 g/mol
단동위원소 질량
446.08001248

이름 및 식별자

우선 이름
1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis((4-chlorophenyl)amino)-, 1,4-dimethyl ester
IUPAC
dimethyl 2,5-bis(4-chloroanilino)cyclohexa-1,4-diene-1,4-dicarboxylate

이름 및 동의어

1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis((4-chlorophenyl)amino)-, dimethyl ester1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis((4-chlorophenyl)amino)-, 1,4-dimethyl ester1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis[(4-chlorophenyl)amino]-, dimethyl ester1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis[(4-chlorophenyl)amino]-, 1,4-dimethyl esterRefChem:41656171329-03-8SCHEMBL1415617DTXSID00749282,5-di(p-chloroanilino)-3,6-dihydroterephthalic acid dimethyl esterdimethyl 2,5-bis(4-chloroanilino)cyclohexa-1,4-diene-1,4-dicarboxylateDimethyl 2,5-bis{(4-chlorophenyl)amino}cyclohexa-1,4-diene-1,4-dicarboxylate

데이터베이스 식별자

CAS
71329-03-8
PubChem CID
14745935
DTXSID
DTXSID0074928

물성

구조 계산 물성

XLogP
6.2
극성 표면적
76.7 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
6
회전 가능 결합 수
8
무거운 원자 수
30

안전 및 규제

유해성 정보

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

화학 및 산업

용도 및 제조

General Manufacturing Information1,4-Cyclohexadiene-1,4-dicarboxylic acid, 2,5-bis[(4-chlorophenyl)amino]-, 1,4-dimethyl ester: ACTIVE

관련 반응

6건

연결된 노트

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