2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethan-1-amine

HCID 28293777

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基本情報

CAS: 1008526-48-4
標準SMILES: CC1(C)OC[C@H](CCN)O1
InChIKey: YBYAUYKHQWYPSD-LURJTMIESA-N
分子式: C7H15NO2
平均分子量: 145.2 g/mol
単同位体質量: 145.11027872

名称と識別子

優先名称: 2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethan-1-amine
IUPAC: 2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanamine
英語名: (S)-2-(2,2-dimethyl-1,3-dioxolan-4-yl)ethan-1-amine
分子式: C7H15NO2
分子量: 145.2

名称と別名

1008526-48-42-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethan-1-amine2-((4S)-2,2-dimethyl-1,3-dioxolan-4-yl)ethan-1-amineRefChem:449331844-150-21,3-Dioxolane-4-ethanamine,2,2-dimethyl-,(4S)-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanamine(S)-2-(2,2-Dimethyl-1,3-dioxolan-4-yl)ethan-1-amineSCHEMBL368918YBYAUYKHQWYPSD-LURJTMIESA-NEN300-2930679(S)-2-(2,2-Dimethyl-[1,3]dioxolan-4-yl)ethylamine

名称をさらに表示

1,3-Dioxolane-4-ethanamine, 2,2-dimethyl-, (4S)-

2-((S)-2,2-dimethyl-[1,3]dioxolan-4-yl)-ethylamine

データベース識別子

CAS: 1008526-48-4
PubChem CID: 28293777
EC Number: 844-150-2

物性

構造計算による物性

XLogP: -0.1
極性表面積: 44.5 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: 2
重原子数: 10
形式電荷: 0
複雑度: 114

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H227 (100%): Combustible liquid [Warning Flammable liquids]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P210, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.