基本情報
- 標準SMILES
Nc1cc(S(=O)(=O)[O-])c(O)c2c1C(=O)c1c(O)c(S(=O)(=O)[O-])cc(N)c1C2=O.[Na+].[Na+]- InChIKey
WSALIDVQXCHFEG-UHFFFAOYSA-L- 分子式
- C14H8N2Na2O10S2
- 平均分子量
- 474.3 g/mol
- 単同位体質量
- 473.94157502
名称と識別子
- 優先名称
- Acid Blue 45
- IUPAC
- disodium;4,8-diamino-1,5-dihydroxy-9,10-dioxoanthracene-2,6-disulfonate
名称と別名
Acid Blue 452861-02-1C.I. Acid Blue 455Y5526NL81CI 63010DTXSID90889462NSC-41818NSC-476992,6-Anthracenedisulfonic acid, 4,8-diamino-9,10-dihydro-1,5-dihydroxy-9,10-dioxo-, disodium saltDisodium 4,8-diamino-1,5-dihydroxy-9,10-dioxoanthracene-2,6-disulphonate2,6-Anthracenedisulfonic acid, 4,8-diamino-9,10-dihydro-1,5-dihydroxy-9,10-dioxo-, sodium salt (1:2)SODIUM 4,8-DIAMINO-1,5-DIHYDROXYANTHRAQUINONE-2,6-DISULFONATE
名称をさらに表示
DISODIUM 4,8-DIAMINO-1,5-DIHYDROXYANTHRAQUINONE-2,6-DISULFONATE1,5-DIHYDROXY-4,8-DIAMINOANTHRAQUINONE-2,6-DISULFONIC ACID, DISODIUM SALT2,6-ANTHRAQUINONEDISULFONIC ACID, 4,8-DIAMINO-1,5-DIHYDROXY-, DISODIUM SALTRefChem:552563DTXCID501028715Acid Alizarine Sapphire BCI Acid Blue 45Airedale Blue B
データベース識別子
- CAS
2861-02-1- PubChem CID
- 72278
- DTXSID
DTXSID90889462- UNII
- 5Y5526NL81
- EC Number
- 220-678-3
物性
構造計算による物性
- 極性表面積
- 258 Ų
- 水素結合供与体数
- 4
- 水素結合受容体数
- 12
- 回転可能結合数
- 0
- 重原子数
- 30
- 形式電荷
- 0
- 複雑度
- 791
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 1.2% (26 of 2117) of reports.
Warning
H302 (94.9%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2117 reports by companies from 4 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: 2,6-Anthracenedisulfonic acid, 4,8-diamino-9,10-dihydro-1,5-dihydroxy-9,10-dioxo-, disodium salt
REACH registered substance: Disodium 4,8-diamino-1,5-dihydroxy-9,10-dioxoanthracene-2,6-disulphonate (EC: 220-678-3)
2,6-Anthracenedisulfonic acid, 4,8-diamino-9,10-dihydro-1,5-dihydroxy-9,10-dioxo-, disodium salt: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 4 (94.9%)
安全と保護具
Protective Action Criteria (PAC)
4.8 [mg/m3]
52 [mg/m3]
310 [mg/m3]
化学と産業
用途と製造
General Manufacturing Information2,6-Anthracenedisulfonic acid, 4,8-diamino-9,10-dihydro-1,5-dihydroxy-9,10-dioxo-, sodium salt (1:2): ACTIVE
関連反応
1 件
関連ノート
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