基本情報
- CAS
181531-25-9- 標準SMILES
Nc1c(N=Nc2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2)c(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(O)c12- InChIKey
YOXGONFCUARMMN-UHFFFAOYSA-N- 分子式
- C18H17N3O13S4
- 平均分子量
- 611.6 g/mol
- 単同位体質量
- 610.9644223
名称と識別子
- 優先名称
- 2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, reaction products with 2-amino-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-5-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]benzenesulfonic acid, sodium salts
- IUPAC
- 4-amino-5-hydroxy-3-[[4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2,7-disulfonic acid
- 英語名
- 2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-4-2-(sulfooxy)ethylsulfonylphenylazo-, reaction products with 2-amino-4-(4-amino-6-chloro-1,3,5-triazin-2-yl)amino-5-4-2-(sulfooxy)ethylsulfonylphenylazobenzenesulfonic acid, sodium salts
- 分子式
- C18H17N3O13S4
- 分子量
- 611.59988
名称と別名
181531-25-92,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-((4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo)-, reaction products with 2-amino-4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-5-((4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo)benzenesulfonic acid, sodium salts2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, reaction products with 2-amino-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-5-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]benzenesulfonic acid, sodium saltsRefChem:44618382572-37-0EINECS 279-998-74-Amino-5-hydroxy-3-((4-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)naphthalene-2,7-disulphonic acidSCHEMBL7977352SCHEMBL13069904DTXSID80722657YOXGONFCUARMMN-UHFFFAOYSA-NDTXSID701112273
名称をさらに表示
2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-4-2-(sulfooxy)ethylsulfonylphenylazo-, reaction products with 2-amino-4-(4-amino-6-chloro-1,3,5-triazin-2-yl)amino-5-4-2-(sulfooxy)ethylsulfonylphenylazobenzenesulfonic acid, sodium salts
物性
構造計算による物性
- XLogP
- 0.1
- 極性表面積
- 311 Ų
- 水素結合供与体数
- 5
- 水素結合受容体数
- 16
- 回転可能結合数
- 9
- 重原子数
- 38
- 形式電荷
- 0
- 複雑度
- 1,290
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。
危険有害性情報
Regulatory Information
Chemical: 2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, reaction products with 2-amino-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-5-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]benzenesulfonic acid, sodium salts
2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, reaction products with 2-amino-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-5-[[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]benzenesulfonic acid, sodium salts: 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.
関連反応
0 件
現在のフィルター条件では反応記録がありません。
化合物ノート
読み込み中…