CAS 38060-08-1 2-(Morpholin-4-yl)-1-phenylethan-1-amine (HCID 2814462)

基本情報

CAS: 38060-08-1
標準SMILES: NC(CN1CCOCC1)c1ccccc1
InChIKey: CLAGARRWBBUZDR-UHFFFAOYSA-N
分子式: C12H18N2O
平均分子量: 206.28 g/mol
単同位体質量: 206.1419132

名称と識別子

優先名称: 2-(Morpholin-4-yl)-1-phenylethan-1-amine
IUPAC: 2-morpholin-4-yl-1-phenylethanamine
現地名: 2-モルホリン-4-イル-1-フェニルエチルアミン
英語名: 2-Morpholin-4-yl-1-phenylethylamine
分子式: C12H18N2O
分子量: 206.29

名称と別名

2-(Morpholin-4-Yl)-1-Phenylethan-1-AmineRefChem:461452968-677-338060-08-12-Morpholin-4-yl-1-phenylethylamine2-morpholino-1-phenylethanamine2-morpholin-4-yl-1-phenylethanamine2-morpholino-1-phenylethan-1-amineMFCD018625322-Morpholin-4-ylphenethyl amine2-(4-morpholinyl)-1-phenylethanamine2-(Morpholin-4-yl)-1-phenylethylamine

名称をさらに表示

2-モルホリン-4-イル-1-フェニルエチルアミンTIMTEC-BB SBB010175ASINEX-REAG BAS 096151014-Morpholineethanamine,a-phenyl-4-Morpholineethanamine, α-phenyl-4-(2-Amino-2-phenylethyl)morpholine

a-Phenyl-4-morpholineethanamineCHEMBL203233SCHEMBL2554004DTXSID50384640CLAGARRWBBUZDR-UHFFFAOYSA-NHMS1704I02AR3539SBB010175

データベース識別子

CAS: 38060-08-1
PubChem CID: 2814462
DTXSID: DTXSID50384640
ChEMBL: CHEMBL203233
EC Number: 968-677-3

物性

構造計算による物性

XLogP: 0.5
極性表面積: 38.5 Å²
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: 3
重原子数: 15
形式電荷: 0
複雑度: 174

物理化学的性質

沸点: 150 · 150-152 °C(Press: 3 Torr)
比重(密度): 1.078 · 1.078±0.06 g/cm3(Predicted)
酸解離定数(Pka): 10.29 · 10.29±0.10(Predicted)

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.