(2-Aminoethyl)(benzyl)methylamine 分子结构式
HCID3014812

(2-Aminoethyl)(benzyl)methylamine

N'-benzyl-N'-methylethane-1,2-diamine

C10H16N2164.25 g/molCAS 14165-18-5

IDENTITY

结构与身份

标准SMILES
CN(CCN)Cc1ccccc1
InChIKey
LIUGRXFEJOSPIA-UHFFFAOYSA-N
分子式
C10H16N2
平均分子量
164.25 g/mol
单同位素质量
164.13134852

COMPUTED

结构计算性质

已同步
XLogP
1
极性表面积
29.3 Ų
氢键供体
1
氢键受体
2
可旋转键
4
重原子
12
形式电荷
0
复杂度
108

GHS

GHS分类

GHS Classification

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (33.3%): 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

Hazard Classes and Categories

Acute Tox. 4 (100%);Acute Tox. 4 (33.3%);Skin Irrit. 2 (33.3%);Eye Irrit. 2 (66.7%);Acute Tox. 4 (33.3%);STOT SE 3 (33.3%)

ALIASES

名称与别名

共 38 条
(2-aminoethyl)(benzyl)methylamineRefChem:395345674-689-714165-18-5N1-Benzyl-N1-methylethane-1,2-diaminen-benzyl-n-methyl-ethane-1,2-diamineN-Benzyl-N-methyl-1,2-diaminoethaneN-BENZYL-N-METHYLETHANE-1,2-DIAMINEMFCD03030356N'-benzyl-N'-methylethane-1,2-diamine1,2-Ethanediamine, N-methyl-N-(phenylmethyl)-N-Methyl-N-(phenylmethyl)-1,2-ethanediamineCHEMBL4470484ChemDiv2_003237N1-Methyl-N1-benzyl-1,2-ethanediamineorb3176185SCHEMBL1395704DTXSID60161782N-benzyl-N-methylethylene-diamineLIUGRXFEJOSPIA-UHFFFAOYSA-N

REACTIONS

相关反应

9
HRID 4215 反应方程式

uspto-grants-1988_02 · 10.6084/m9.figshare.5104873.v1 · US04724235

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HRID 119159 反应方程式

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

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HRID 580011 反应方程式

uspto-grants-1988_06 · 10.6084/m9.figshare.5104873.v1 · US04751228

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HRID 637588 反应方程式

uspto-grants-1985_12 · 10.6084/m9.figshare.5104873.v1 · US04556654

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HRID 638380 反应方程式

uspto-grants-1985_12 · 10.6084/m9.figshare.5104873.v1 · US04560755

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HRID 745183 反应方程式

uspto-grants-1986_07 · 10.6084/m9.figshare.5104873.v1 · US04597902

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HRID 832311 反应方程式

Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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HRID 1248761 反应方程式

uspto-grants-1985_06 · 10.6084/m9.figshare.5104873.v1 · US04525589

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