HCID13037020

(1,2,3,4-Tetrahydronaphthalen-1-yl)urea

1,2,3,4-tetrahydronaphthalen-1-ylurea

C11H14N2O190.24 g/molCAS 58490-97-4

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IDENTITY

结构与身份

标准SMILES: NC(=O)NC1CCCc2ccccc21
InChIKey: PLSFSIDDNZKALV-UHFFFAOYSA-N
分子式: C11H14N2O
平均分子量: 190.24 g/mol
单同位素质量: 190.11061307

COMPUTED

结构计算性质

已同步

XLogP: 1.7
极性表面积: 55.1 Å²
氢键供体: 2
氢键受体: 1
可旋转键: 1
重原子: 14
形式电荷: 0
复杂度: 217

GHS

GHS分类

来源：PubChem

GHS Classification

Warning

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

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

HAZARDS

危害信息

来源：PubChem

Hazard Classes and Categories

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

ALIASES

名称与别名

共 17 条

(1,2,3,4-tetrahydronaphthalen-1-yl)urea58490-97-41,2,3,4-tetrahydronaphthalen-1-ylurea1,2,3,4-Tetrahydro-1-naphthylurea(R)-(1,2,3,4-Tetrahydronaphthalen-1-yl)-ureaSCHEMBL2358933SCHEMBL30046159PLSFSIDDNZKALV-UHFFFAOYSA-NICA49097AKOS009095955(1,2,3,4-tetrahydro-1-naphtyl)urea(1,2,3,4-tetrahydro-1-naphthyl)ureaCS-0250981EN300-53094G35469AB01005626-01Z198194414

REACTIONS

参与反应

11 条

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

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uspto-grants-1978_05 · 10.6084/m9.figshare.5104873.v1 · US04089976

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uspto-grants-1977_12 · 10.6084/m9.figshare.5104873.v1 · US04062856

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

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uspto-grants-1982_06 · 10.6084/m9.figshare.5104873.v1 · US04332724

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uspto-grants-1982_06 · 10.6084/m9.figshare.5104873.v1 · US04332724

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Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

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uspto-grants-1977_01 · 10.6084/m9.figshare.5104873.v1 · US04005140

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