2-(2-Fluorophenyl)propan-2-amine 分子结构式
HCID13569520

2-(2-Fluorophenyl)propan-2-amine

C9H12FN153.2 g/molCAS 74702-88-8

IDENTITY

结构与身份

标准SMILES
CC(C)(N)c1ccccc1F
InChIKey
KAQOIUQXYMVFJE-UHFFFAOYSA-N
分子式
C9H12FN
平均分子量
153.2 g/mol
单同位素质量
153.09537755

COMPUTED

结构计算性质

已同步
XLogP
1.5
极性表面积
26 Ų
氢键供体
1
氢键受体
2
可旋转键
1
重原子
11
形式电荷
0
复杂度
134

GHS

GHS分类

GHS Classification

Danger

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]

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

HAZARDS

危害信息

Hazard Classes and Categories

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

ALIASES

名称与别名

共 20 条
2-(2-fluorophenyl)propan-2-amine74702-88-8RefChem:453897845-007-71-(2-fluorophenyl)-1-methylethylamine2-(2-Fluorophenyl)propane-2-amineSCHEMBL1239429SCHEMBL18706010SCHEMBL28186451SCHEMBL30017695KAQOIUQXYMVFJE-UHFFFAOYSA-NMFCD09904468XH06972-(2-fluorophenyl) propane-2-amineAKOS009996386AT39846BS-29454CS-0207534EN300-221379F891407

REACTIONS

相关反应

8
HRID 674618 反应方程式

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

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HRID 1362721 反应方程式

uspto-grants-2011_02 · 10.6084/m9.figshare.5104873.v1 · US07880009B2

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HRID 1362722 反应方程式

uspto-grants-2011_02 · 10.6084/m9.figshare.5104873.v1 · US07880009B2

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HRID 1446577 反应方程式

uspto-grants-2010_02 · 10.6084/m9.figshare.5104873.v1 · US07667041B2

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HRID 1446578 反应方程式

uspto-grants-2010_02 · 10.6084/m9.figshare.5104873.v1 · US07667041B2

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HRID 2247585 反应方程式

uspto-grants-2010_03 · 10.6084/m9.figshare.5104873.v1 · US07687640B2

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HRID 2247586 反应方程式

uspto-grants-2010_03 · 10.6084/m9.figshare.5104873.v1 · US07687640B2

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HRID 2276770 反应方程式

uspto-grants-2015_09 · 10.6084/m9.figshare.5104873.v1 · US09133123B2

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