Cas no 72143-21-6 (Benzenepropanoic acid,2-hydroxyethyl ester)
72143-21-6 structure
Product Name:Benzenepropanoic acid,2-hydroxyethyl ester
CAS No:72143-21-6
MF:C11H14O3
MW:194.227063655853
CID:566793
PubChem ID:3018319
Update Time:2025-04-19
Benzenepropanoic acid,2-hydroxyethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzenepropanoic acid,2-hydroxyethyl ester
- 2-hydroxyethyl 3-phenylpropanoate
- 2-hydroxyethyl 3-phenylpropionate
- NS00062655
- DTXSID70992867
- 72143-21-6
- SCHEMBL6425149
- EINECS 276-381-4
-
- Inchi： 1S/C11H14O3/c12-8-9-14-11(13)7-6-10-4-2-1-3-5-10/h1-5,12H,6-9H2
- InChI Key： YVNBSYGHQJLAIN-UHFFFAOYSA-N
- SMILES： O(CCO)C(CCC1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 194.09432
- Monoisotopic Mass: 194.094
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 6
- Complexity: 162
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.7
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- Density: 1.124
- Boiling Point: 334°C at 760 mmHg
- Flash Point: 142.9°C
- Refractive Index: 1.525
- PSA: 46.53
Benzenepropanoic acid,2-hydroxyethyl ester Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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