HCID3082434

2(4-Biphenyl)propionic acid

3-(4-phenylphenyl)propanoic acid

C15H14O2226.27 g/molCAS 35888-99-4

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IDENTITY

结构与身份

标准SMILES: O=C(O)CCc1ccc(-c2ccccc2)cc1
InChIKey: MVFHRQWYCXYYMU-UHFFFAOYSA-N
分子式: C15H14O2
平均分子量: 226.27 g/mol
单同位素质量: 226.09937969

COMPUTED

结构计算性质

已同步

XLogP: 3.5
极性表面积: 37.3 Å²
氢键供体: 1
氢键受体: 2
可旋转键: 4
重原子: 17
形式电荷: 0
复杂度: 235

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)

Aggregated GHS information provided per 5 reports by companies from 2 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

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

ALIASES

名称与别名

共 42 条

35888-99-42(4-Biphenyl)propionic acid2(para-biphenyl)propionic acidDTXSID00189445RefChem:80477DTXCID301119363-(4-phenylphenyl)propanoic acid3-([1,1'-biphenyl]-4-yl)propanoic acid3-(4-Biphenyl)propionic acid3-(biphenyl-4-yl)propanoic acid3-(4-biphenylyl)propionic acidMFCD06823979Biphenyl-4-propanoic acid[1,1'-Biphenyl]-4-propanoic acid(1,1'-Biphenyl)-4-propanoic acidorb3022742SCHEMBL1211561SCHEMBL1510089SCHEMBL15101863-(4-biphenylyl)propanoic acid

REACTIONS

参与反应

4 条

全部作为反应物作为生成物作为试剂作为催化剂作为溶剂

HRID70871

uspto-grants-2014_09

作为反应物

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08822534B2

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HRID333322

uspto-grants-2014_11

作为反应物

uspto-grants-2014_11 · 10.6084/m9.figshare.5104873.v1 · US08877815B2

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HRID815467

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

作为反应物

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

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HRID1945048

uspto-grants-2013_03

作为反应物

uspto-grants-2013_03 · 10.6084/m9.figshare.5104873.v1 · US08394853B2

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