Pentasodium bis[5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-hydroxy-5-nitrophenyl)azo]naphthalene-2,7-disulphonato(4-)]chromate(5-)
기본 정보
- CAS
79828-43-6- 표준 SMILES
Nc1nc(Cl)nc(Nc2cc(S(=O)(=O)O)cc3cc(S(=O)(=O)O)c(N=Nc4cc([N+](=O)[O-])ccc4O)c(O)c23)n1.Nc1nc(Cl)nc(Nc2cc(S(=O)(=O)O)cc3cc(S(=O)(=O)O)c(N=Nc4cc([N+](=O)[O-])ccc4O)c(O)c23)n1.[Cr].[Na+].[Na+].[Na+].[Na+].[Na+]- InChIKey
YTVMSKVHGIODIV-UHFFFAOYSA-N- 분자식
- C38H26Cl2CrN16Na5O20S4+5
- 평균 분자량
- 1,392.8 g/mol
- 단동위원소 질량
- 1,390.866268
이름 및 식별자
- 우선 이름
- Pentasodium bis[5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-hydroxy-5-nitrophenyl)azo]naphthalene-2,7-disulphonato(4-)]chromate(5-)
- IUPAC
- pentasodium;bis(5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-hydroxy-5-nitrophenyl)diazenyl]naphthalene-2,7-disulfonic acid);chromium
이름 및 동의어
EINECS 279-318-9Chromate(5-), bis(5-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-hydroxy-5-nitrophenyl)azo)-2,7-naphthalenedisulfonato(4-))-, pentapotassiumPentasodium bis(5-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-hydroxy-5-nitrophenyl)azo)naphthalene-2,7-disulphonato(4-))chromate(5-)Chromate(5-), bis[5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-hydroxy-5-nitrophenyl)azo]-2,7-naphthalenedisulfonato(4-)]-, pentapotassiumPentasodium bis[5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-hydroxy-5-nitrophenyl)azo]naphthalene-2,7-disulphonato(4-)]chromate(5-)RefChem:860043279-317-3279-318-979828-44-7
데이터베이스 식별자
- CAS
79828-43-6、79828-44-7- PubChem CID
- 136180117
- EC Number
- 279-317-3、279-318-9
물성
구조 계산 물성
- 극성 표면적
- 626 Ų
- 수소 결합 공여자 수
- 12
- 수소 결합 수용자 수
- 34
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 86
- 형식 전하
- 5
- 복잡도
- 2,520
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 17.2% (5 of 29) of reports.
Warning
H317 (82.8%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 29 reports by companies from 2 notifications to the ECHA C&L Inventory.
This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.
유해성 정보
Regulatory Information
Chemical: Chromate(5-), bis[5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-hydroxy-5-nitrophenyl)azo]-2,7-naphthalenedisulfonato(4-)]-, pentapotassium
REACH registered substance: Pentasodium bis[5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-hydroxy-5-nitrophenyl)azo]naphthalene-2,7-disulphonato(4-)]chromate(5-) (EC: 279-317-3)
Other Safety InformationIMAP assessments - Chromate(5-), bis[5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(2-hydroxy-5-nitrophenyl)azo]-2,7-naphthalenedisulfonato(4-)]-, pentapotassium: Human health tier I assessment
Hazard Classes and Categories
Skin Sens. 1 (82.8%)
Not Classified
관련 반응
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