CAS 64281-29-4 N1-(pyridin-4-yl)ethane-1,2-diamine (HCID 14834209)

基本情報

CAS: 64281-29-4
標準SMILES: NCCNc1ccncc1
InChIKey: HWVWEGOXLGPYDB-UHFFFAOYSA-N
分子式: C7H11N3
平均分子量: 137.18 g/mol

名称と識別子

優先名称: N1-(pyridin-4-yl)ethane-1,2-diamine
IUPAC: N'-pyridin-4-ylethane-1,2-diamine
英語名: N -4-Pyridinyl-1,2-ethanediamine
分子式: C7H11N3
分子量: 137.18

名称と別名

N1-(pyridin-4-yl)ethane-1,2-diamineRefChem:831424975-681-964281-29-4N-(2-aminoethyl)pyridin-4-amineMFCD084375034-(2-Aminoethylamino)-pyridine hydrochloride1,2-Ethanediamine, N1-4-pyridinyl-n(4-pyridyl)ethylenediamineN-(4-Pyridyl)ethylenediamineSCHEMBL16784224-(2-Aminoethylamino)-pyridine

名称をさらに表示

N-(pyridin-4-yl)ethylenediamineN1-4-pyridinyl-1,2-EthanediaMineN -4-Pyridinyl-1,2-ethanediamine4-(2-Aminoethylamino)-pyridine xN1-(Pyridine-4-yl)ethane-1,2-diamine4-(2-AMINOETHYLAMINO)-PYRIDINE X HCL4-(2-AMINOETHYLAMINO)-PYRIDINE X HCL >98%

HWVWEGOXLGPYDB-UHFFFAOYSA-N2-(pyridin-4-yl-amino)-ethylamineN'-(4-pyridyl)ethane-1,2-diamineN'-pyridin-4-ylethane-1,2-diamineAKOS000192389N-(pyridin-4-yl)ethane-1,2-diamineAS-93932EN300-50103

データベース識別子

CAS: 64281-29-4
PubChem CID: 14834209
EC Number: 975-681-9

物性

構造計算による物性

XLogP: -0.1
極性表面積: 50.9 Å²
水素結合供与体数: 2
水素結合受容体数: 3
回転可能結合数: 3
重原子数: 10
形式電荷: 0
複雑度: 78.9

物理化学的性質

融点: 190 · 190-195°
沸点: 304 · 304.0±22.0 °C(Predicted)
比重(密度): 1.121 · 1.121±0.06 g/cm3(Predicted)
酸解離定数(Pka): 9.17 · 9.17±0.10(Predicted)

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

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)

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.