4-Amino-alpha-methylbenzenemethanol 分子结构式
HCID85753

4-Amino-alpha-methylbenzenemethanol

1-(4-aminophenyl)ethanol

C8H11NO137.18 g/molCAS 14572-89-5

IDENTITY

结构与身份

标准SMILES
CC(O)c1ccc(N)cc1
InChIKey
JDEYBJHOTWGYFE-UHFFFAOYSA-N
分子式
C8H11NO
平均分子量
137.18 g/mol
单同位素质量
137.08406397

COMPUTED

结构计算性质

已同步
XLogP
0.8
极性表面积
46.3 Ų
氢键供体
2
氢键受体
2
可旋转键
1
重原子
10
形式电荷
0
复杂度
97

GHS

GHS分类

来源:PubChem
GHS Classification

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning 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+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 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

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

ALIASES

名称与别名

共 43 条
14572-89-54-Amino-alpha-methylbenzyl alcohol4-Amino-alpha-methylbenzenemethanolRefChem:518034238-613-21-(4-Aminophenyl)ethanol4-(1-Hydroxyethyl)aniline4-aminophenyl ethanol1-(4-aminophenyl)ethan-1-olMFCD00014781Benzenemethanol, 4-amino-alpha-methyl-(R)-1-(4-Aminophenyl)ethan-1-ol(S)-1-(4-Aminophenyl)ethan-1-ol4-Amino-a-methyl-benzenemethanolEINECS 238-613-21-(p-aminophenyl)ethanol1-(4-aminophenyl)-ethanol4-Aminophenyl methylcarbinolSCHEMBL566671-(4-amino-phenyl)-ethanol

REACTIONS

参与反应

23
HRID 150669 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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HRID 404453 反应方程式

uspto-grants-2014_06 · 10.6084/m9.figshare.5104873.v1 · US08748421B2

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HRID 450038 反应方程式

uspto-grants-2013_07 · 10.6084/m9.figshare.5104873.v1 · US08486962B2

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HRID 536838 反应方程式

uspto-grants-2014_10 · 10.6084/m9.figshare.5104873.v1 · US08859542B2

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HRID 649610 反应方程式

uspto-grants-1988_04 · 10.6084/m9.figshare.5104873.v1 · US04740581

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HRID 707110 反应方程式

uspto-grants-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09174963B2

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HRID 879904 反应方程式

uspto-grants-2015_03 · 10.6084/m9.figshare.5104873.v1 · US08992963B2

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HRID 886999 反应方程式

uspto-grants-2012_08 · 10.6084/m9.figshare.5104873.v1 · US08247411B2

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