(4-メトキシ-3,5-ジメチルフェニル)アミン

4-Methoxy-3,5-dimethylaniline

HCID 4166097

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 39785-37-0
標準SMILES: COc1c(C)cc(N)cc1C
InChIKey: HUPGZEYAAFYLSC-UHFFFAOYSA-N
分子式: C9H13NO
平均分子量: 151.21 g/mol
単同位体質量: 151.09971404

名称と識別子

優先名称: 4-Methoxy-3,5-dimethylaniline
IUPAC: 4-methoxy-3,5-dimethylaniline
現地名: (4-メトキシ-3,5-ジメチルフェニル)アミン
英語名: 4-Amino-2,6-dimethylanisole
分子式: C9H13NO
分子量: 151.21

名称と別名

4-methoxy-3,5-dimethylaniline39785-37-0DTXSID70400154RefChem:293821DTXCID103510104-Amino-2,6-dimethylanisole3,5-dimethyl-4-methoxyaniline2,6-Dimethyl-4-aminoanisoleMFCD01907075(4-Methoxy-3,5-dimethylphenyl)amine4-Methoxy-3,5-dimethyl-benzenamine4-methoxy-3,5-dimethylphenylamine

名称をさらに表示

(4-メトキシ-3,5-ジメチルフェニル)アミン3,5-ジメチル-4-メトキシアニリン4-アミノ-2,6-ジメチルアニソール3,5-Dimethyl-4-methoxyaniline 97%3,5-Dimethyl-4-methoxyaniline 99+%4-methoxy-3,5-dimethyl-benzeneamine

Benzenamine, 4-methoxy-3,5-dimethyl-4-Methoxy-35-dimethylaniline4-methoxy-3,5-dimethyl-aniline2,6-dimethyl-p-anisidineOprea1_709534SCHEMBL655455CHEMBRDG-BB 6989550ALBB-010306

データベース識別子

CAS: 39785-37-0
PubChem CID: 4166097
DTXSID: DTXSID70400154
EC Number: 642-651-9
Nikkaji: J3.601.163G

物性

構造計算による物性

XLogP: 1.9
極性表面積: 35.3 Å²
水素結合供与体数: 1
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: 115

物理化学的性質

融点: 62 · 62-65℃
貯蔵温度: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
外見: powder
色: Brown

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H301+H311+H331 (16.7%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.