1-Aminoanthraquinone
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基本情報
- CAS
25620-59-1- 標準SMILES
Nc1cccc2c1C(=O)c1ccccc1C2=O- InChIKey
KHUFHLFHOQVFGB-UHFFFAOYSA-N- 分子式
- C14H9NO2
- 平均分子量
- 223.23 g/mol
- 単同位体質量
- 223.06332853
名称と識別子
- 優先名称
- 1-Aminoanthraquinone
- IUPAC
- 1-aminoanthracene-9,10-dione
- 英語名
- amino-10-anthracenedione
- 分子式
- C14H9NO2
- 分子量
- 223.23
名称と別名
1-AMINOANTHRAQUINONE82-45-1Diazo Fast Red ALAnthraquinone, 1-amino-1-Amino-9,10-anthraquinone9,10-Anthracenedione, 1-amino-1-Amino-9,10-anthracenedioneN5YYY1NEUIDTXSID2052572NSC-458NSC-30415RefChem:907485
名称をさらに表示
amino-10-anthracenedioneamino-9,10-Anthracenedione
DTXCID9031145201-423-51-aminoanthracene-9,10-dione1-Amino anthraquinone1-Aminoanthrachinonalpha-Aminoanthraquinonealpha-Anthraquinonylamine1-Amino-anthraquinone
データベース識別子
- CAS
25620-59-1、82-45-1- PubChem CID
- 6710
- DTXSID
DTXSID2052572- ChEMBL
CHEMBL88502- UNII
- N5YYY1NEUI
- EC Number
- 201-423-5
- Nikkaji
- J55.383B
物性
構造計算による物性補完中
- XLogP
- 3.2
- 極性表面積
- 60.2 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 3
- 回転可能結合数
- 0
- 重原子数
- 17
- 形式電荷
- 0
- 複雑度
- 352
実験および物理化学的性質
Chemical ClassesDyes -> Anthraquinone Dyes
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP2.87
Physical DescriptionRuby-red solid; [Merck Index] Dark red to brown crystalline powder; [Acros Organics MSDS]
物理化学的性質
- EPAの化学物質情報
- 9 · 9,10-Anthracenedione, amino- (25620-59-1)
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 9.1% (1 of 11) of reports.
Warning
H312 (18.2%): Harmful in contact with skin [Warning Acute toxicity, dermal]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 11 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
危険有害性情報
Regulatory InformationREACH registered substance: 1-aminoanthraquinone (EC: 201-423-5)
Hazards Summary
An oral repeated-dose/reproductive/developmental toxicity study of rats demonstrated histopathological changes of the kidney and spleen, disappearance of nursing behavior, decreased pup viability on postnatal day 4, and NOAEL's for repeated-dose and reproductive toxicity of less than 40 mg/kg/day (lowest tested dose); No adverse effects on reproductive parameters or teratogenicity observed; [OECD SIDS: 1-Aminoanthraquinone - 1996] Not a skin or eye irritant in rabbits; [IUCLID] A mild eye irritant; Causes excitement, weight loss, and changes of the liver and kidney in inhalation studies of rats; Causes normocytic anemia, weight loss, and organ changes (liver, spleen, and heart) in 2-week oral studies of guinea pigs; [RTECS] A mild eye irritant; [Acros Organics MSDS] See 1-Amino-5-chloroanthraquinone.
Hazard Classes and Categories
Acute Tox. 4 (18.2%)
Serious eye damage/eye irritation - Category 2B
安全データ
- tsca
- TSCA listed
化学と産業
用途と製造
UsesUsed to make dyes and pharmaceuticals; [Merck Index]
General Manufacturing Information
9,10-Anthracenedione, 1-amino-: ACTIVE
9,10-Anthracenedione, amino-: INACTIVE
関連反応
132 件
化合物ノート
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