기본 정보
- CAS
53918-53-9- 표준 SMILES
CCC(C)(C)c1ccc(OCCCC(=O)Nc2ccc(Cl)c(NC(=O)C(Oc3ccc(C(=O)O)cc3)C(=O)C(C)(C)C)c2)c(C(C)(C)CC)c1- InChIKey
UHUHWJMSXWDGAT-UHFFFAOYSA-N- 분자식
- C40H51ClN2O7
- 평균 분자량
- 707.3 g/mol
- 단동위원소 질량
- 706.3384797
이름 및 식별자
- 우선 이름
- Benzoic acid, 4-[1-[[[5-[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]amino]carbonyl]-3,3-dimethyl-2-oxobutoxy]-
- IUPAC
- 4-[1-[5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoylamino]-2-chloroanilino]-4,4-dimethyl-1,3-dioxopentan-2-yl]oxybenzoic acid
- 영어명
- 2-[(4-Carboxy-phenoxy)-4,4-dimethyl-3-oxo-pentanoic acid-[2- chlor-5- [4-(2,4-di-tert-pentyl-phenoxy)-butyramido]]-anilide
- 분자식
- C40H51ClN2O7
- 분자량
- 707.3
이름 및 동의어
EINECS 258-863-6Benzoic acid, 4-[1-[[[5-[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]amino]carbonyl]-3,3-dimethyl-2-oxobutoxy]-DTXSID70886075Benzoic acid, 4-(1-(((5-((4-(2,4-bis(1,1-dimethylpropyl)phenoxy)-1-oxobutyl)amino)-2-chlorophenyl)amino)carbonyl)-3,3-dimethyl-2-oxobutoxy)-RefChem:565871DTXCID90102541853918-53-94-[1-[5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoylamino]-2-chloroanilino]-4,4-dimethyl-1,3-dioxopentan-2-yl]oxybenzoic acid2-[(4-CARBOXY-PHENOXY)-4,4-DIMETHYL-3-OXO-PENTANOIC ACID-[2- CHLOR-5- [4-(2,4-DI-TERT-PENTYL-PHENOXY)-BUTYRAMIDO]]-ANILIDE4-[(1-{[5-({4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoyl}amino)-2-chlorophenyl]amino}-4,4-dimethyl-1,3-dioxopentan-2-yl)oxy]benzoic acidUHUHWJMSXWDGAT-UHFFFAOYSA-NMFCD00142811
이름 더 보기
4-[alpha-2-chloro-5-[4-[2,4-di-tert-pentylphenoxy)butyramiCHLORO-DI-T-PENTYLPHENOXYBUTYRAMIDO-PH- CARBAMOYLPIVALOYL-MEO-BENZOIC ACID
물성
구조 계산 물성
- XLogP
- 10.4
- 극성 표면적
- 131 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 17
- 무거운 원자 수
- 50
- 형식 전하
- 0
- 복잡도
- 1,140
실험 및 물리화학적 성질
Endocrine DisruptorsPotential endocrine disrupting compound
물리화학적 성질
- EPA
- 4 · Benzoic acid, 4-[1-[[[5-[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]amino]carbonyl]-3,3-dimethyl-2-oxobutoxy]- (53918-53-9)
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 InformationBenzoic acid, 4-[1-[[[5-[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]amino]carbonyl]-3,3-dimethyl-2-oxobutoxy]-: INACTIVE
공급사4 곳
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
ORGANICA+49 3494636389 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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