3'-アミノアセトアニリド
m-Aminoacetanilide
基本情報
- CAS
102-28-3- 標準SMILES
CC(=O)Nc1cccc(N)c1- InChIKey
PEMGGJDINLGTON-UHFFFAOYSA-N- 分子式
- C8H10N2O
- 平均分子量
- 150.18 g/mol
- 単同位体質量
- 150.07931295
概要
M-aminoacetanilide is a gray solid. (NTP, 1992)
名称と識別子
- 優先名称
- m-Aminoacetanilide
- IUPAC
- N-(3-aminophenyl)acetamide
- 現地名
- 3'-アミノアセトアニリド
- 英語名
- N1-(3-Aminophenyl)acetamide
- 分子式
- C8H10N2O
- 分子量
- 150.18
名称と別名
N-(3-Aminophenyl)acetamide102-28-33'-AminoacetanilideM-AMINOACETANILIDE3-AcetamidoanilineAcetamide, N-(3-aminophenyl)-M-Acetaminoanilinem-(Acetylamino)anilineN-Acetyl-m-phenylenediamine3-Amino-N-acetylaniline3-Aminoacetanilid3-Acetylaminoaniline
名称をさらに表示
3'-アミノアセトアニリドアセチル-m-フェニレンジアミンN-アセチル-1,3-フェニレンジアミンN-(3-アミノフェニル)アセトアミドm-アミノアセトアニリドN-アセチル-m-フェニレンジアミン3-アミノセトアニリド3′-アミノアセトアニリド3-アセトアミドアニリンアミノアセトアニリド3'-アミノアセトアニリド, 97%META AMINO ACETANILIDE3-AMINOACETANILIDEFR-2203AKOS BB-8162WLN: ZR CMV13-AcetamidoaniLASISCHEM B52481
Acetanilide, 3'-amino-1-Amino-3-(acetylamino)benzene3-Aminoacetanilid [Czech]3-(Acetylamino)anilinem-AcetamidoanilineN-Acetyl-m-fenylendiaminCCRIS 4574NSC 165576
データベース識別子
- CAS
102-28-3- PubChem CID
- 7604
- DTXSID
DTXSID2024454- ChEMBL
CHEMBL1606123- UNII
- Q5K7HYS7JJ
- EC Number
- 203-021-5
- Nikkaji
- J43.351I
物性
構造計算による物性
- XLogP
- 0.9
- 極性表面積
- 55.1 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 2
- 回転可能結合数
- 1
- 重原子数
- 11
- 形式電荷
- 0
- 複雑度
- 147
実験および物理化学的性質
Chemical ClassesNitrogen Compounds -> Other Aromatics (Nitrogen)
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Solubility10 to 50 mg/mL at 75 °F (NTP, 1992)
Boiling PointDecomposes at 1449 °F (NTP, 1992)
Melting Point187.7 to 189.5 °F (NTP, 1992)
Physical Description
M-aminoacetanilide is a gray solid. (NTP, 1992)
Gray solid; [CAMEO] Light brown crystalline powder; [Acros Organics MSDS]
物理化学的性質
- 融点
- 86 · 86-88 °C(lit.)
- 沸点
- 271.72 °C · 271.72°C (rough estimate)
- 比重(密度)
- 1.1392 · 1.1392 (rough estimate)
- 屈折率
- 1.618 · 1.6180 (estimate)
- 貯蔵温度
- Keep in dark place,Inert atmosphere,Room temperature
- 外見
- powder to crystal
- 酸解離定数(Pka)
- 14.82 · 14.82±0.70(Predicted)
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
Warning
H302 (21.1%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 57 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory InformationREACH registered substance: 3'-aminoacetanilide (EC: 203-021-5)
Fire HazardsFlash point data concerning this compound are not available, however, it is probably combustible. (NTP, 1992)
Health HazardsACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits toxic fumes. (NTP, 1992)
Hazards SummaryA mild eye irritant; [RTECS] An irritant; [Acros Organics MSDS] See Acetanilide.
Reactive GroupAmides and Imides
Reactivity Profile
Aromatic amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides.
Air and Water ReactionsSoluble in water.
化学と産業
用途と製造
UsesUsed in organic synthesis; [NTP]
General Manufacturing InformationAcetamide, N-(3-aminophenyl)-: ACTIVE
応用分野
用途有機合成原料。
使用3'-Aminoacetanilide is mainly used as reaction intermediates dyes and disperse dyes.
一般的な説明Gray solid.
上流・下流製品情報
上流原料
関連反応
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