基本情報
- CAS
64560-69-6- 標準SMILES
CC1=NN(c2ccccc2)C(=O)C1=NN=C1C=CC(N([O-])[O-])=CC1=O.Cc1nn(-c2ccccc2)c([O-])c1N=Nc1ccc([N+](=O)[O-])cc1[O-].[Cr+3].[Na+]- InChIKey
WLPGLWOTPIQCSK-UHFFFAOYSA-L- 分子式
- C32H22CrN10O8.Na
- 平均分子量
- 749.6 g/mol
- 単同位体質量
- 749.092482
名称と識別子
- 優先名称
- Sodium bis[2,4-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)]chromate(1-)
- IUPAC
- sodium;chromium(3+);4-[[4-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]-5-methyl-2-phenylpyrazol-3-one;3-methyl-4-[(4-nitro-2-oxidophenyl)diazenyl]-1-phenylpyrazol-5-olate
名称と別名
Chromate(1-), bis(2,4-dihydro-4-((2-hydroxy-4-nitrophenyl)azo)-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-))-, sodiumChromate(1-), bis[2,4-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)]-, sodiumSodium bis(2,4-dihydro-4-((2-hydroxy-4-nitrophenyl)azo)-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-))chromate(1-)Sodium bis[2,4-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)]chromate(1-)RefChem:887309264-944-7EINECS 264-944-7Chromate(1-), bis(2-((5-hydroxy-3-methyl-1-phenylpyrazol-4-yl)azo)-5-nitrophenolato(2-))-, sodiumWLPGLWOTPIQCSK-UHFFFAOYSA-LChromate(1-), bis(2,4-dihydro-4-((2-(hydroxy-kappaO)-4-nitrophenyl)azo-kappaN1)-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)-kappaO3)-, sodium
データベース識別子
- CAS
64560-69-6- PubChem CID
- 163053
- EC Number
- 264-944-7
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
- 0
- 水素結合受容体数
- 15
- 回転可能結合数
- 5
- 重原子数
- 52
- 形式電荷
- 0
- 複雑度
- 493
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
H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 108 reports by companies from 2 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: Chromate(1-), bis[2,4-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)]-, sodium
REACH registered substance: Sodium bis[2,4-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)]chromate(1-) (EC: 264-944-7)
Other Safety InformationIMAP assessments - Chromate(1-), bis[2,4-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)]-, sodium: Human health tier I assessment
Hazard Classes and CategoriesAquatic Chronic 2 (100%)
関連反応
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