Cas no 765302-52-1 (Benzeneacetic acid,4-ethyl-3-hydroxy-, ethyl ester)
765302-52-1 structure
Product Name:Benzeneacetic acid,4-ethyl-3-hydroxy-, ethyl ester
CAS No:765302-52-1
MF:C12H16O3
MW:208.253643989563
CID:550650
PubChem ID:21079760
Update Time:2025-04-19
Benzeneacetic acid,4-ethyl-3-hydroxy-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetic acid,4-ethyl-3-hydroxy-, ethyl ester
- Benzeneacetic acid, 4-ethyl-3-hydroxy-, ethyl ester (9CI)
- LDSSZAKPTWIXGJ-UHFFFAOYSA-N
- Ethyl 3-hydroxy-4-ethylphenylacetate
- 765302-52-1
- ethyl 2-(4-ethyl-3-hydroxyphenyl)acetate
- (4-Ethyl-3-hydroxy-phenyl)-acetic acid ethyl ester
- SCHEMBL3204861
-
- Inchi： 1S/C12H16O3/c1-3-10-6-5-9(7-11(10)13)8-12(14)15-4-2/h5-7,13H,3-4,8H2,1-2H3
- InChI Key： LDSSZAKPTWIXGJ-UHFFFAOYSA-N
- SMILES： OC1C=C(C=CC=1CC)CC(=O)OCC
Computed Properties
- Exact Mass: 208.10998
- Monoisotopic Mass: 208.11
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 203
- 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
- Topological Polar Surface Area: 46.5A^2
- XLogP3: 2.5
Experimental Properties
- PSA: 46.53
Benzeneacetic acid,4-ethyl-3-hydroxy-, ethyl ester Related Literature
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
765302-52-1 (Benzeneacetic acid,4-ethyl-3-hydroxy-, ethyl ester) Related Products
- 22446-38-4(Ethyl 3-Hydroxyphenylacetate)
- 67828-42-6(Methyl 2,4-dihydroxyphenylacetate)
- 67828-62-0(Ethyl 2-(2,4-dihydroxyphenyl)acetate)
- 22446-37-3(Methyl 2-(2-hydroxyphenyl)acetate)
- 6056-23-1(Benzeneacetic acid,2-methoxy-, ethyl ester)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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