3-Amino-1-(diphenylmethyl)azetidine 分子结构式
HCID5744546

3-Amino-1-(diphenylmethyl)azetidine

1-benzhydrylazetidin-3-amine

C16H18N2238.33 g/molCAS 40432-52-8

IDENTITY

结构与身份

标准SMILES
NC1CN(C(c2ccccc2)c2ccccc2)C1
InChIKey
LYTNNHXGUOKXFI-UHFFFAOYSA-N
分子式
C16H18N2
平均分子量
238.33 g/mol
单同位素质量
238.14699858

COMPUTED

结构计算性质

已同步
XLogP
2.4
极性表面积
29.3 Ų
氢键供体
1
氢键受体
2
可旋转键
3
重原子
18
形式电荷
0
复杂度
230

GHS

GHS分类

来源:PubChem
GHS Classification

Warning

H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (66.7%): 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+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 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

Acute Tox. 4 (66.7%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (66.7%)

ALIASES

名称与别名

共 38 条
3-AMINO-1-(DIPHENYLMETHYL)AZETIDINE1-(diphenylmethyl)-3-azetidinamineRefChem:496764640-915-81-benzhydrylazetidin-3-amine40432-52-83-amino-1-diphenylmethylazetidine1-(diphenylmethyl)azetidin-3-amine1-benzhydryl-3-aminoazetidineMFCD030933861-benzhydryl-azetidin-3-ylamine852655-92-63-Azetidinamine, 1-(diphenylmethyl)-1-benzhydryl-3-azetanamineSCHEMBL724661-benzhydrylazetidin-3-ylamine3-amino-1-benzhydryl azetidineorb3169848SCHEMBL5695024DTXSID40960831

REACTIONS

参与反应

28
HRID 117704 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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HRID 161434 反应方程式

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

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HRID 207314 反应方程式

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

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HRID 323605 反应方程式

uspto-grants-2001_04 · 10.6084/m9.figshare.5104873.v1 · US06214832B1

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HRID 366430 反应方程式

uspto-grants-2000_10 · 10.6084/m9.figshare.5104873.v1 · US06130217

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HRID 366466 反应方程式

uspto-grants-2000_10 · 10.6084/m9.figshare.5104873.v1 · US06130217

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HRID 412643 反应方程式

uspto-grants-2003_05 · 10.6084/m9.figshare.5104873.v1 · US06562964B1

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HRID 620924 反应方程式

uspto-grants-1989_04 · 10.6084/m9.figshare.5104873.v1 · US04822895

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