huagongshe.com
结构：O=C(O)CCc1cnc2ccccc2c1
HCID12415751

3-(Quinolin-3-yl)propanoic acid

3-quinolin-3-ylpropanoic acid

C12H11NO2201.22 g/molCAS 67752-28-7
查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准 SMILES
O=C(O)CCc1cnc2ccccc2c1
InChIKey
PDVKRIXEUOTSJQ-UHFFFAOYSA-N
分子式
C12H11NO2
平均分子量
201.22 g/mol
单同位素质量
201.07897859

COMPUTED

结构计算性质

已同步
XLogP
1.9
极性表面积
50.2 Ų
氢键供体
1
氢键受体
3
可旋转键
3
重原子
15
形式电荷
0
复杂度
230

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 26 条
3-(QUINOLIN-3-YL)PROPANOIC ACID67752-28-73-Quinolinepropanoic acidDTXSID10497240RefChem:496162DTXCID10448050849-696-5MFCD110407433-quinolin-3-ylpropanoic acid3-Quinolin-3-yl-propionic acidquinoline-3-propionic acid3-(3-quinolyl)propanoic acidSCHEMBL28463473-(3-quinolinyl)propanoic acidPDVKRIXEUOTSJQ-UHFFFAOYSA-NSCA75228AKOS015151575SB711773-(QUINOLIN-3-YL)PROPANOICACIDAS-60630

REACTIONS

参与反应

1 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