基本情報
- CAS
6420-44-6- 標準SMILES
COc1ccccc1N=Nc1c(S(=O)(=O)[O-])cc2cc(NC(=O)Nc3ccc4c(O)c(N=Nc5ccc(S(=O)(=O)[O-])cc5C)c(S(=O)(=O)[O-])cc4c3)ccc2c1O.[Na+].[Na+].[Na+]- InChIKey
MSBHLDQWHHNCML-UHFFFAOYSA-K- 分子式
- C35H25N6Na3O13S3
- 平均分子量
- 902.8 g/mol
- 単同位体質量
- 902.03348124
名称と識別子
- 優先名称
- 2-Naphthalenesulfonic acid, 4-hydroxy-7-((((5-hydroxy-6-(2-(2-methoxyphenyl)diazenyl)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-3-(2-(2-methyl-4-sulfophenyl)diazenyl)-, sodium salt (1:3)
- IUPAC
- trisodium;4-hydroxy-7-[[5-hydroxy-6-[(2-methoxyphenyl)diazenyl]-7-sulfonatonaphthalen-2-yl]carbamoylamino]-3-[(2-methyl-4-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate
名称と別名
2-Naphthalenesulfonic acid, 4-hydroxy-7-((((5-hydroxy-6-(2-(2-methoxyphenyl)diazenyl)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-3-(2-(2-methyl-4-sulfophenyl)diazenyl)-, sodium salt (1:3)2-Naphthalenesulfonic acid, 4-hydroxy-7-((((5-hydroxy-6-((2-methoxyphenyl)azo)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-3-((2-methyl-4-sulfophenyl)azo)-, trisodium salt2-Naphthalenesulfonic acid, 4-hydroxy-7-[[[[5-hydroxy-6-[(2-methoxyphenyl)azo]-7-sulfo-2-naphthalenyl]amino]carbonyl]amino]-3-[(2-methyl-4-sulfophenyl)azo]-, trisodium salt2-Naphthalenesulfonic acid, 4-hydroxy-7-[[[[5-hydroxy-6-[2-(2-methoxyphenyl)diazenyl]-7-sulfo-2-naphthalenyl]amino]carbonyl]amino]-3-[2-(2-methyl-4-sulfophenyl)diazenyl]-, sodium salt (1:3)RefChem:476734direct red 246420-44-6Vegentine Scarlet 4BMitsui Direct Fast Scarlet 4BSLCalcomine Scarlet 4BNCErie Fast Scarlet 4BABenzo Fast Scarlet 4BA
名称をさらに表示
Diazol Fast Scarlet 4BADirect Fast Scarlet 4BAAtlantic Fast Scarlet 4BABelamine Fast Scarlet 4BABenzo Scarlet 4BASDiazamine Fast Scarlet 4BADiphenyl Fast Scarlet 4BSWHispamin Fast Scarlet 4BAS
物性
構造計算による物性
- 極性表面積
- 337 Ų
- 水素結合供与体数
- 4
- 水素結合受容体数
- 17
- 回転可能結合数
- 7
- 重原子数
- 60
- 形式電荷
- 0
- 複雑度
- 1,760
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Warning
H351: Suspected of causing cancer [Warning Carcinogenicity]
危険有害性情報
Regulatory InformationChemical: 2-Naphthalenesulfonic acid, 4-hydroxy-7-[[[[5-hydroxy-6-[(2-methoxyphenyl)azo]-7-sulfo-2-naphthalenyl]amino]carbonyl]amino]-3-[(2-methyl-4-sulfophenyl)azo]-, trisodium salt
Other Safety InformationIMAP assessments - Dyes that could release selected carcinogenic amines (listed on AICS): Human health tier II assessment
Hazard Classes and Categories
Skin Irrit. 2 (100%)
Carcinogenicity - category 2
化学と産業
用途と製造
General Manufacturing Information2-Naphthalenesulfonic acid, 4-hydroxy-7-[[[[5-hydroxy-6-[2-(2-methoxyphenyl)diazenyl]-7-sulfo-2-naphthalenyl]amino]carbonyl]amino]-3-[2-(2-methyl-4-sulfophenyl)diazenyl]-, sodium salt (1:3): ACTIVE
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