기본 정보
- CAS
68400-40-8- 표준 SMILES
CCN(Cc1ccccc1)c1ccc(N=Nc2cc(S(=O)(=O)O)ccc2S(=O)(=O)c2ccc(C)cc2)cc1- InChIKey
IJJGDLXWIBIJMW-UHFFFAOYSA-N- 분자식
- C28H27N3O5S2
- 평균 분자량
- 549.7 g/mol
- 단동위원소 질량
- 549.13921332
이름 및 식별자
- 우선 이름
- Benzenesulfonic acid, 3-(2-(4-(ethyl(phenylmethyl)amino)phenyl)diazenyl)-4-((4-methylphenyl)sulfonyl)-
- IUPAC
- 3-[[4-[benzyl(ethyl)amino]phenyl]diazenyl]-4-(4-methylphenyl)sulfonylbenzenesulfonic acid
- 현지명
- 3-[[4-[에틸톨릴아미노]페닐]아조]-4-[4-톨릴술포닐]벤젠술폰산
- 영어명
- 3-[[4-[ethyltolylamino]phenyl]azo]-4-[4-tolylsulphonyl]benzenesulphonic acid
- 분자식
- C28H27N3O5S2
- 분자량
- 549.66
이름 및 동의어
Benzenesulfonic acid, 3-((4-(ethyl(phenylmethyl)amino)phenyl)azo)-4-((4-methylphenyl)sulfonyl)-EINECS 270-029-33-((4-(Ethyl(phenylmethyl)amino)phenyl)azo)-4-((4-methylphenyl)sulfonyl)benzenesulfonic acidBenzenesulfonic acid, 3-[[4-[ethyl(phenylmethyl)amino]phenyl]azo]-4-[(4-methylphenyl)sulfonyl]-Benzenesulfonic acid, 3-(2-(4-(ethyl(phenylmethyl)amino)phenyl)diazenyl)-4-((4-methylphenyl)sulfonyl)-Benzenesulfonic acid, 3-[2-[4-[ethyl(phenylmethyl)amino]phenyl]diazenyl]-4-[(4-methylphenyl)sulfonyl]-RefChem:56429668400-40-8DTXSID2071497IJJGDLXWIBIJMW-UHFFFAOYSA-N3-((4-(Ethyltolylamino)phenyl)azo)-4-(4-tolylsulphonyl)benzenesulphonic acidNS00036577
이름 더 보기
3-[[4-[에틸톨릴아미노]페닐]아조]-4-[4-톨릴술포닐]벤젠술폰산3-[[4-[ethyltolylamino]phenyl]azo]-4-[4-tolylsulphonyl]benzenesulphonic acid3-[[4-[Ethyl(phenylmethyl)amino]phenyl]azo]-4-[(4-methylphenyl)sulfonyl]benzenesulfonic acid
3-({4-[Benzyl(ethyl)amino]phenyl}diazenyl)-4-(4-methylbenzene-1-sulfonyl)benzene-1-sulfonic acid
물성
구조 계산 물성
- XLogP
- 5.6
- 극성 표면적
- 133 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 38
- 형식 전하
- 0
- 복잡도
- 969
물리화학적 성질
- EPA
- 3 · Benzenesulfonic acid, 3-[[4-[ethyl(phenylmethyl)amino]phenyl]azo]-4-[(4-methylphenyl)sulfonyl]- (68400-40-8)
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 InformationBenzenesulfonic acid, 3-[2-[4-[ethyl(phenylmethyl)amino]phenyl]diazenyl]-4-[(4-methylphenyl)sulfonyl]-: INACTIVE
관련 반응
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