HCID273661

3-Phenylcyclohexanone

3-phenylcyclohexan-1-one

C12H14O174.24 g/molCAS 20795-53-3

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IDENTITY

结构与身份

标准 SMILES: O=C1CCCC(c2ccccc2)C1
InChIKey: CJAUDSQXFVZPTO-UHFFFAOYSA-N
分子式: C12H14O
平均分子量: 174.24 g/mol
单同位素质量: 174.10446507

COMPUTED

结构计算性质

已同步

XLogP: 2.3
极性表面积: 17.1 Å²
氢键供体: 0
氢键受体: 1
可旋转键: 1
重原子: 13
形式电荷: 0
复杂度: 180

GHS

GHS 分类

来源：PubChem

GHS Classification

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning 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, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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

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

ALIASES

名称与别名

共 32 条

3-Phenylcyclohexanone3-phenylcyclohexan-1-oneDTXSID70297900RefChem:504944DTXCID40249037832-830-120795-53-33-Phenyl-cyclohexanoneCyclohexanone, 3-phenyl-MFCD00209998(S)-3-PHENYL-CYCLOHEXANONE3-Phenylcyclohexanone; (+/-)-3-Phenylcyclohexanone; NSC 119037;CJ-12406NSC1190373-phenyl cyclohexanone3-Phenylcyclohexanone #3-phenyl-cyclohexan-1-oneSCHEMBL714528SCHEMBL28000269AKOS006272468

REACTIONS