1-Cyclohexylpyrrolidin-3-amine 分子结构式
HCID3670074

1-Cyclohexylpyrrolidin-3-amine

C10H20N2168.28 g/molCAS 46037-45-0

IDENTITY

结构与身份

标准SMILES
NC1CCN(C2CCCCC2)C1
InChIKey
DPEPZAJVZHRORQ-UHFFFAOYSA-N
分子式
C10H20N2
平均分子量
168.28 g/mol
单同位素质量
168.16264865

COMPUTED

结构计算性质

已同步
XLogP
1.3
极性表面积
29.3 Ų
氢键供体
1
氢键受体
2
可旋转键
1
重原子
12
形式电荷
0
复杂度
141

GHS

GHS分类

GHS Classification

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, 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 Corr. 1B (100%);STOT SE 3 (100%)

ALIASES

名称与别名

共 25 条
1-cyclohexylpyrrolidin-3-amine46037-45-0RefChem:431748887-673-11-Cyclohexyl-3-pyrrolidinylamine dihydrochloride1-cyclohexyl-3-aminopyrrolidine1-Cyclohexyl-3-pyrrolidinamine 2HClMFCD01572475Oprea1_123418N-cyclohexyl-3-aminopyrrolidineSCHEMBL13068803-amino-1-cyclohexylpyrrolidineSCHEMBL117333461-cyclohexylpyrrolidine-3-ylamineDPEPZAJVZHRORQ-UHFFFAOYSA-NWBA03745SBB0185381-CYCLOHEXYL-3-PYRROLIDINAMINEAKOS009455399NS-01370

REACTIONS

相关反应

31
HRID 127410 反应方程式

uspto-grants-1981_03 · 10.6084/m9.figshare.5104873.v1 · US04255580

查看
HRID 184303 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

查看
HRID 306255 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

查看
HRID 371616 反应方程式

uspto-grants-1978_05 · 10.6084/m9.figshare.5104873.v1 · US04087428

查看
HRID 371617 反应方程式

uspto-grants-1978_05 · 10.6084/m9.figshare.5104873.v1 · US04087428

查看
HRID 441405 反应方程式

uspto-grants-1977_08 · 10.6084/m9.figshare.5104873.v1 · US04039678

查看
HRID 441406 反应方程式

uspto-grants-1977_08 · 10.6084/m9.figshare.5104873.v1 · US04039678

查看
HRID 616254 反应方程式

uspto-grants-1978_02 · 10.6084/m9.figshare.5104873.v1 · US04073796

查看