Cas no 70192-58-4 (Benzoic acid, 3-methyl-, 2-hydroxyethyl ester)
70192-58-4 structure
Product Name:Benzoic acid, 3-methyl-, 2-hydroxyethyl ester
CAS No:70192-58-4
MF:C10H12O3
MW:180.200483322144
CID:1741743
Update Time:2024-11-27
Benzoic acid, 3-methyl-, 2-hydroxyethyl ester Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 3-methyl-, 2-hydroxyethyl ester
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- Inchi： 1S/C10H12O3/c1-8-3-2-4-9(7-8)10(12)13-6-5-11/h2-4,7,11H,5-6H2,1H3
- InChI Key： NEKGHNXKFVBGAV-UHFFFAOYSA-N
- SMILES： C(OCCO)(=O)C1=CC=CC(C)=C1
Computed Properties
- Exact Mass: 180.07866
Experimental Properties
- Density: 1.143±0.06 g/cm3(Predicted)
- Boiling Point: 313.4±25.0 °C(Predicted)
- PSA: 46.53
- pka: 13.85±0.10(Predicted)
Benzoic acid, 3-methyl-, 2-hydroxyethyl ester Related Literature
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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