结构:CNCCCC(OC)OC
HCID22563572

(4,4-Dimethoxybutyl)(methyl)amine

4,4-dimethoxy-N-methylbutan-1-amine

C7H17NO2147.22 g/molCAS 98433-78-4

IDENTITY

结构与身份

标准 SMILES
CNCCCC(OC)OC
InChIKey
WMVCCLHRNIGZRL-UHFFFAOYSA-N
分子式
C7H17NO2
平均分子量
147.22 g/mol
单同位素质量
147.12592879

COMPUTED

结构计算性质

已同步
XLogP
0.4
极性表面积
30.5 Ų
氢键供体
1
氢键受体
3
可旋转键
6
重原子
10
形式电荷
0
复杂度
64

GHS

GHS 分类

来源:PubChem
GHS Classification

Danger

H227 (100%): Combustible liquid [Warning Flammable liquids];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]

P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, 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.

HAZARDS

危害信息

来源:PubChem
Hazard Classes and Categories

Flam. Liq. 4 (100%);Acute Tox. 4 (100%);Skin Irrit. 2 (100%);Eye Dam. 1 (100%);STOT SE 3 (100%)

ALIASES

名称与别名

9
(4,4-dimethoxybutyl)(methyl)amine98433-78-4RefChem:401810882-339-14,4-dimethoxy-N-methylbutan-1-amineSCHEMBL1120392WMVCCLHRNIGZRL-UHFFFAOYSA-NAKOS006357593EN300-7191878

REACTIONS

参与反应

21
HRID689341

Training data from https://doi.org/10.1039/C8SC04228D (3/10)

作为反应物
HRID 689341 方程式

Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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