1-[4-(アミノメチル)フェニル]-N,N-ジメチルメタンアミン

4-Dimethylaminomethylbenzylamine

HCID 193714

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 34490-85-2
標準SMILES: CN(C)Cc1ccc(CN)cc1
InChIKey: LYABQIBGTULUFB-UHFFFAOYSA-N
分子式: C10H16N2
平均分子量: 164.25 g/mol
単同位体質量: 164.13134851

概要

structure

名称と識別子

優先名称: 4-Dimethylaminomethylbenzylamine
IUPAC: [4-[(dimethylamino)methyl]phenyl]methanamine
現地名: 1-[4-(アミノメチル)フェニル]-N,N-ジメチルメタンアミン
英語名: 4-dimethylaminomethylbenzylamine
分子式: C10H16N2
分子量: 164.25

名称と別名

34490-85-24-Dimethylaminomethylbenzylaminep-Dimethylaminomethylbenzylamine1,4-Benzenedimethanamine, N,N-dimethyl-RefChem:987731-(4-(Aminomethyl)phenyl)-N,N-dimethylmethanamine4-Dimethylaminomethyl-benzylamineMFCD04107485[4-[(dimethylamino)methyl]phenyl]methanamine1-[4-(Aminomethyl)phenyl]-N,N-dimethylmethanamine{4-[(dimethylamino)methyl]phenyl}methanamineN-[4-(aminomethyl)benzyl]-N,N-dimethylamine

名称をさらに表示

1-[4-(アミノメチル)フェニル]-N,N-ジメチルメタンアミン[4-(アミノメチル)ベンジル]ジメチルアミン二塩酸塩[4-(Aminomethyl)benzyl]dimethylamine dihydrochlorideDimethylaminomethyl-benzylamineN1,N1-DiMethyl-1,4-benzenediMethanaMine1,4-BenzenediMethanaMine,N1,N1-diMethyl-8N-[4-(Aminomethyl)benzyl]-N,N--dimethylamine1-(4-(Aminomethyl)phenyl)-N,N-dimethylmethanamine - [A93122]1-[4-(aminomethyl)phenyl]-N,N-dimethylmethanamine(SALTDATA: 2HCl)1-(4-(aminomethyl)phenyl)-N,N-dimethylmethanamine dihydrochloride[4-(aMinoMethyl)benzyl]diMethylaMine dihydrochloride (SALTDATA: 2HCl)

4-(Dimethylaminomethyl)benzylamine[4-(Aminomethyl)benzyl]dimethylaminedihydrochlorideSCHEMBL3972958DTXSID10956029LYABQIBGTULUFB-UHFFFAOYSA-NHMS1704G05ALBB-015114[4-(aminomethyl)benzyl]dimethylamine

データベース識別子

CAS: 34490-85-2
PubChem CID: 193714
DTXSID: DTXSID10956029
EC Number: 806-370-7

物性

構造計算による物性

XLogP: 0.6
極性表面積: 29.3 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: 3
重原子数: 12
形式電荷: 0
複雑度: 115

物理化学的性質

沸点: 82 · 82-84 °C(Press: 0.60 Torr)
比重(密度): 0.989 · 0.989±0.06 g/cm3(Predicted)
貯蔵温度: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
酸解離定数(Pka): 9.05 · 9.05±0.10(Predicted)

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P264+P265, P280, P305+P354+P338, and P317 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesEye Dam. 1 (100%)

安全データ

hs_code: 2921599090
hazard_class: IRRITANT

化学と産業

サプライヤー34 社

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Sichuan Biosynce Pharmatech Co., Ltd.[email protected]

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上海爱孜康医药研究有限公司18721109360 · [email protected]

上海凌凯科技股份有限公司58950110 13124863828 · [email protected]

化合物ノート

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