基本情報
- CAS
70210-37-6- 標準SMILES
Cc1ccccc1Oc1ccccc1N=Nc1c(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])cc(NC(=O)c3ccccc3)c2c1O.[Na+].[Na+]- InChIKey
UZSOSPUHRLUDJW-UHFFFAOYSA-L- 分子式
- C30H21N3Na2O9S2
- 平均分子量
- 677.6 g/mol
- 単同位体質量
- 677.05146017
名称と識別子
- 優先名称
- 2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-(2-(2-(2-methylphenoxy)phenyl)diazenyl)-, sodium salt (1:2)
- IUPAC
- disodium;5-benzamido-4-hydroxy-3-[[2-(2-methylphenoxy)phenyl]diazenyl]naphthalene-2,7-disulfonate
- 現地名
- 5-(ベンゾイルアミノ)-4-ヒドロキシ-3-[2-(2-メチルフェノキシ)フェニルアゾ]-2,7-ナフタレンジスルホン酸ジナトリウム
- 英語名
- disodium 5-(benzoylamino)-4-hydroxy-3-[[2-(2-methylphenoxy)phenyl]azo]naphthalene-2,7-disulphonate
- 分子式
- C30H21N3Na2O9S2
- 分子量
- 677.61198
名称と別名
70210-37-6EINECS 274-434-6DTXSID808900622,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-(2-(2-(2-methylphenoxy)phenyl)diazenyl)-, sodium salt (1:2)2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-[2-[2-(2-methylphenoxy)phenyl]diazenyl]-, sodium salt (1:2)RefChem:83544DTXCID201029314Disodium 5-(benzoylamino)-4-hydroxy-3-[[2-(2-methylphenoxy)phenyl]azo]naphthalene-2,7-disulphonate5-(benzoylamino)-4-hydroxy-3-2-(2-methylphenoxy)phenylazonaphthalene-2,7-disulphonate (sodium salt)disodium;5-benzamido-4-hydroxy-3-[[2-(2-methylphenoxy)phenyl]diazenyl]naphthalene-2,7-disulfonate2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-((2-(2-methylphenoxy)phenyl)azo)-, disodium salt2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-[[2-(2-methylphenoxy)phenyl]azo]-, disodium salt
名称をさらに表示
5-(ベンゾイルアミノ)-4-ヒドロキシ-3-[2-(2-メチルフェノキシ)フェニルアゾ]-2,7-ナフタレンジスルホン酸ジナトリウム
物性
構造計算による物性
- 極性表面積
- 214 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 11
- 回転可能結合数
- 6
- 重原子数
- 46
- 形式電荷
- 0
- 複雑度
- 1,200
物理化学的性質
- 比重(密度)
- 1.673 · 1.673[at 20℃]
- 水溶解度
- 6.03 g/L · 6.03g/L at 20℃
- LogP
- -1.904 at · -1.904 at 20℃
- EPAの化学物質情報
- 2 · 2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-[[2-(2-methylphenoxy)phenyl]azo]-, disodium salt (70210-37-6)
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
This chemical does not meet GHS hazard criteria for 98.2% (107 of 109) of all reports.
Not Classified
Aggregated GHS information provided per 109 reports by companies from 4 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: 2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-[[2-(2-methylphenoxy)phenyl]azo]-, disodium salt
REACH registered substance: Disodium 5-(benzoylamino)-4-hydroxy-3-[[2-(2-methylphenoxy)phenyl]azo]naphthalene-2,7-disulphonate (EC: 274-434-6)
2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-2-(2-methylphenoxy)phenylazo-, disodium 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 - 2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-[[2-(2-methylphenoxy)phenyl]azo]-, disodium salt: Human health tier I assessment
Hazard Classes and CategoriesNot Classified
安全データ
- tsca
- TSCA listed
化学と産業
用途と製造
Household ProductsInformation on 8 consumer products that contain 2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-(2-(2-(2-methylphenoxy)phenyl)diazenyl)-, sodium salt (1:2) in the following categories is provided:
General Manufacturing Information2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-4-hydroxy-3-[2-[2-(2-methylphenoxy)phenyl]diazenyl]-, sodium salt (1:2): ACTIVE
サプライヤー4 社
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