HCID21883780

3-Aminohexan-1-ol

C6H15NO117.19 g/molCAS 68889-61-2

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IDENTITY

结构与身份

标准SMILES: CCCC(N)CCO
InChIKey: YZOKDOZIDBMHOK-UHFFFAOYSA-N
分子式: C6H15NO
平均分子量: 117.19 g/mol
单同位素质量: 117.1153641

COMPUTED

结构计算性质

已同步

XLogP: 0.3
极性表面积: 46.3 Å²
氢键供体: 2
氢键受体: 2
可旋转键: 4
重原子: 8
形式电荷: 0
复杂度: 47

GHS

GHS分类

来源：PubChem

GHS Classification

Danger

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, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, 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.

HAZARDS

危害信息

来源：PubChem

Hazard Classes and Categories

Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

ALIASES

名称与别名

共 13 条

3-aminohexan-1-ol68889-61-2DTXSID50619388RefChem:276651DTXCID50570142862-425-51-Hexanol, 3-amino-MFCD03412696SCHEMBL1335718SCHEMBL6244126AKOS006278082EN300-315400N12794

REACTIONS

参与反应

1 条

Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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