기본 정보
- 표준 SMILES
Cc1cc(N=Nc2ccc(Nc3nc(Cl)nc(Cl)n3)c3c(S(=O)(=O)[O-])cccc23)c(C)cc1N=Nc1cc(S(=O)(=O)[O-])ccc1S(=O)(=O)[O-].[Na+].[Na+].[Na+]- InChIKey
UPDVDGUOBRUKAJ-UHFFFAOYSA-K- 분자식
- C27H17Cl2N8Na3O9S3
- 평균 분자량
- 833.5 g/mol
- 단동위원소 질량
- 831.93507532
이름 및 식별자
- 우선 이름
- 1,4-Benzenedisulfonic acid, 2-[2-[4-[2-[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-5-sulfo-1-naphthalenyl]diazenyl]-2,5-dimethylphenyl]diazenyl]-, sodium salt (1:3)
- IUPAC
- trisodium;2-[[4-[[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-5-sulfonatonaphthalen-1-yl]diazenyl]-2,5-dimethylphenyl]diazenyl]benzene-1,4-disulfonate
- 현지명
- CI리액티브브라운23
- 영어명
- C.I. Reactive brown 23
- 분자량
- 0
이름 및 동의어
68892-31-9EINECS 272-614-9DTXSID008900041,4-Benzenedisulfonic acid, 2-(2-(4-(2-(4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-5-sulfo-1-naphthalenyl)diazenyl)-2,5-dimethylphenyl)diazenyl)-, sodium salt (1:3)2-((4-((4-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)-5-sulfo-1-naphthalenyl)azo)-2,5-dimethylphenyl)azo)-1,4-benzenedisulfonic acid, trisodium salt71872-78-11,4-Benzenedisulfonic acid, 2-[2-[4-[2-[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-5-sulfo-1-naphthalenyl]diazenyl]-2,5-dimethylphenyl]diazenyl]-, sodium salt (1:3)RefChem:73087DTXCID601078913615-672-61,4-Benzenedisulfonic acid, 2-((4-((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-5-sulfo-1-naphthalenyl)azo)-2,5-dimethylphenyl)azo)-, trisodium salt1,4-Benzenedisulfonic acid, 2-[[4-[[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-5-sulfo-1-naphthalenyl]azo]-2,5-dimethylphenyl]azo]-, trisodium salt
이름 더 보기
CI리액티브브라운23Procion Brown MX-GR2-[[4-[[4-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]-5-sodiosulfo-1-naphthalenyl]azo]-2,5-dimethylphenyl]azo]-1,4-benzenedisulfonic acid disodium salt2-[[4-[[4-[(4,6-Dichloro-1,3,5-triazine-2-yl)amino]-5-sodiosulfo-1-naphthalenyl]azo]-2,5-dimethylphenyl]azo]-1,4-benzenedisulfonic acid disodium salt2-[4-[4-[(4,6-Dichloro-1,3,5-triazine-2-yl)amino]-5-(sodiooxysulfonyl)naphthalene-1-ylazo]-2,5-dimethylphenylazo]benzene-1,4-bis(sulfonic acid sodium) salt
2-4-4-(4,6-dichloro-1,3,5-triazin-2-yl)amino-5-sulphonato-1-naphthylazo-2,5-dimethylphenylazobenzene-1,4-disulph onate (sodium salt)C.I. Reactive Brown 23orb2565384SCHEMBL5576423UPDVDGUOBRUKAJ-UHFFFAOYSA-KNS00090776T87300Trisodium 2-((4-((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-5-sulphonato-1-naphthyl)azo)-2,5-dimethylphenyl)azo)benzene-1,4-disulphonate
데이터베이스 식별자
- CAS
68892-31-9、71872-78-1- PubChem CID
- 163275
- DTXSID
DTXSID00890004- EC Number
- 272-614-9、615-672-6
- Nikkaji
- J215.632F
물성
구조 계산 물성
- 극성 표면적
- 297 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 17
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 52
- 형식 전하
- 0
- 복잡도
- 1,490
안전 및 규제
유해성 정보
Regulatory Information
Chemical: 1,4-Benzenedisulfonic acid, 2-[2-[4-[2-[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-5-sulfo-1-naphthalenyl]diazenyl]-2,5-dimethylphenyl]diazenyl]-, sodium salt (1:3)
1,4-Benzenedisulfonic acid, 2-4-4-(4,6-dichloro-1,3,5-triazin-2-yl)amino-5-sulfo-1-naphthalenylazo-2,5-dimethylphenylazo-, trisodium 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 - 1,4-Benzenedisulfonic acid, 2-[2-[4-[2-[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-5-sulfo-1-naphthalenyl]diazenyl]-2,5-dimethylphenyl]diazenyl]-, sodium salt (1:3): Human health tier I assessment
화학 및 산업
용도 및 제조
General Manufacturing Information1,4-Benzenedisulfonic acid, 2-[2-[4-[2-[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-5-sulfo-1-naphthalenyl]diazenyl]-2,5-dimethylphenyl]diazenyl]-, sodium salt (1:3): INACTIVE
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