나트륨m-[[[4-(벤조티아졸-2-일라조)-m-톨릴]에틸아미노]메틸]벤젠설포네이트
Benzenesulfonic acid, 3-(((4-(2-(2-benzothiazolyl)diazenyl)-3-methylphenyl)ethylamino)methyl)-, sodium salt (1:1)
기본 정보
- CAS
72968-74-2- 표준 SMILES
CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(N=Nc2nc3ccccc3s2)c(C)c1.[Na+]- InChIKey
OLLGHBNUVHGMHJ-UHFFFAOYSA-M- 분자식
- C23H21N4NaO3S2
- 평균 분자량
- 488.6 g/mol
- 단동위원소 질량
- 488.09527717
이름 및 식별자
- 우선 이름
- Benzenesulfonic acid, 3-(((4-(2-(2-benzothiazolyl)diazenyl)-3-methylphenyl)ethylamino)methyl)-, sodium salt (1:1)
- IUPAC
- sodium 3-[[4-(1,3-benzothiazol-2-yldiazenyl)-N-ethyl-3-methylanilino]methyl]benzenesulfonate
- 현지명
- 나트륨m-[[[4-(벤조티아졸-2-일라조)-m-톨릴]에틸아미노]메틸]벤젠설포네이트
- 영어명
- sodium m-[[[4-(benzothiazol-2-ylazo)-m-tolyl]ethylamino]methyl]benzenesulphonate
- 분자식
- C23H21N4NaO3S2
- 분자량
- 489.57
이름 및 동의어
72968-74-2EINECS 277-150-0DTXSID50888335Benzenesulfonic acid, 3-(((4-(2-(2-benzothiazolyl)diazenyl)-3-methylphenyl)ethylamino)methyl)-, sodium salt (1:1)Benzenesulfonic acid, 3-[[[4-[2-(2-benzothiazolyl)diazenyl]-3-methylphenyl]ethylamino]methyl]-, sodium salt (1:1)RefChem:117866DTXCID601027615Benzenesulfonic acid, 3-(((4-(2-benzothiazolylazo)-3-methylphenyl)ethylamino)methyl)-, sodium saltBenzenesulfonic acid, 3-[[[4-(2-benzothiazolylazo)-3-methylphenyl]ethylamino]methyl]-, sodium saltSodium m-(((4-(benzothiazol-2-ylazo)-m-tolyl)ethylamino)methyl)benzenesulphonateOLLGHBNUVHGMHJ-UHFFFAOYSA-MNS00090064
이름 더 보기
나트륨m-[[[4-(벤조티아졸-2-일라조)-m-톨릴]에틸아미노]메틸]벤젠설포네이트sodium m-[[[4-(benzothiazol-2-ylazo)-m-tolyl]ethylamino]methyl]benzenesulphonateBenzenesulfonic acid, 3-4-(2-benzothiazolylazo)-3-methylphenylethylaminomethyl-, sodium salt3-[[[4-[(Benzothiazol-2-yl)azo]-3-methylphenyl]ethylamino]methyl]benzenesulfonic acid sodium salt
물성
구조 계산 물성
- 극성 표면적
- 135 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 33
- 형식 전하
- 0
- 복잡도
- 750
물리화학적 성질
- EPA
- 3 · Benzenesulfonic acid, 3-[[[4-(2-benzothiazolylazo)-3-methylphenyl]ethylamino]methyl]-, sodium salt (72968-74-2)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 9 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: Benzenesulfonic acid, 3-[[[4-(2-benzothiazolylazo)-3-methylphenyl]ethylamino]methyl]-, sodium salt
Benzenesulfonic acid, 3-4-(2-benzothiazolylazo)-3-methylphenylethylaminomethyl-, sodium salt: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety InformationIMAP assessments - Benzenesulfonic acid, 3-[[[4-(2-benzothiazolylazo)-3-methylphenyl]ethylamino]methyl]-, sodium salt: Human health tier I assessment
Hazard Classes and CategoriesAquatic Chronic 2 (100%)
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing InformationBenzenesulfonic acid, 3-[[[4-[2-(2-benzothiazolyl)diazenyl]-3-methylphenyl]ethylamino]methyl]-, sodium salt (1:1): ACTIVE
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