Sodium 3-hydroxy-4-((1-hydroxy-2-naphthyl)azo)naphthalene-1-sulphonate

HCID 135465071CAS 3564-14-5

基本情報

標準SMILES: O=S(=O)([O-])c1cc(O)c(N=Nc2ccc3ccccc3c2O)c2ccccc12.[Na+]
InChIKey: HOWITLLZNKSJOJ-UHFFFAOYSA-M
分子式: C20H13N2NaO5S
平均分子量: 416.4 g/mol
単同位体質量: 416.0442868

名称と識別子

優先名称: Sodium 3-hydroxy-4-((1-hydroxy-2-naphthyl)azo)naphthalene-1-sulphonate
IUPAC: sodium 3-hydroxy-4-[(1-hydroxynaphthalen-2-yl)diazenyl]naphthalene-1-sulfonate

名称と別名

Eriochrome Blue Blackeriochrome blue-black bSodium 3-hydroxy-4-((1-hydroxy-2-naphthyl)azo)naphthalene-1-sulphonateSodium 3-hydroxy-4-[(1-hydroxy-2-naphthyl)azo]naphthalene-1-sulphonate1-Naphthalenesulfonic acid, 3-hydroxy-4-(2-(1-hydroxy-2-naphthalenyl)diazenyl)-, sodium salt (1:1)1-Naphthalenesulfonic acid, 3-hydroxy-4-[2-(1-hydroxy-2-naphthalenyl)diazenyl]-, sodium salt (1:1)RefChem:887015222-639-6Eriochrome Blue Black B3564-14-5Mordant Black 3Diacromo Blue G

名称をさらに表示

Hispacrom Blue BGAlizarine Blue OCBOmega Chrome Blue Black BERICHROME BLUE BLACK BC.I. Mordant Black 3 monosodium saltTertrochrome Blue BDurochrome cyanine GSuperchrome Blue BC

データベース識別子

CAS: 3564-14-5
PubChem CID: 135465071
DTXSID: DTXSID0063074
ChEMBL: CHEMBL471028
UNII: A4JAD3Y6ZQ
EC Number: 222-639-6

物性

構造計算による物性

極性表面積: 131 Å²
水素結合供与体数: 2
水素結合受容体数: 7
回転可能結合数: 3
重原子数: 29
形式電荷: 0
複雑度: 685

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 3 notifications to the ECHA C&L Inventory.

危険有害性情報

Regulatory InformationEriochrome blue-black B: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesEye Irrit. 2 (100%)

化学と産業

用途と製造

General Manufacturing Information1-Naphthalenesulfonic acid, 3-hydroxy-4-[2-(1-hydroxy-2-naphthalenyl)diazenyl]-, sodium salt (1:1): ACTIVE