Cas no 50687-63-3 (Benzoic acid,4-hydroxy-, 4-ethoxyphenyl ester)
50687-63-3 structure
Product Name:Benzoic acid,4-hydroxy-, 4-ethoxyphenyl ester
CAS No:50687-63-3
MF:C15H14O4
MW:258.269264698029
CID:372307
PubChem ID:289817
Update Time:2025-04-19
Benzoic acid,4-hydroxy-, 4-ethoxyphenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,4-hydroxy-, 4-ethoxyphenyl ester
- (4-ethoxyphenyl) 4-hydroxybenzoate
- P-ETHOXYPHENYL-P-HYDROXYBENZOATE
- NSC 152099
- DTXSID70302609
- 50687-63-3
- 4-Hydroxy-benzoic acid 4-ethoxy-phenyl ester
- NSC152099
- SCHEMBL10624035
- 4-ethoxyphenyl 4-hydroxybenzoate
- NSC-152099
-
- Inchi： 1S/C15H14O4/c1-2-18-13-7-9-14(10-8-13)19-15(17)11-3-5-12(16)6-4-11/h3-10,16H,2H2,1H3
- InChI Key： TXCMGEVSDTYAMG-UHFFFAOYSA-N
- SMILES： O(CC)C1C=CC(=CC=1)OC(C1C=CC(=CC=1)O)=O
Computed Properties
- Exact Mass: 258.08922
- Monoisotopic Mass: 258.089209
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 5
- Complexity: 276
- 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: 3.6
- Topological Polar Surface Area: 55.8
Experimental Properties
- Density: 1.219
- Boiling Point: 436.3°C at 760 mmHg
- Flash Point: 164.6°C
- Refractive Index: 1.586
- PSA: 55.76
Benzoic acid,4-hydroxy-, 4-ethoxyphenyl ester Related Literature
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
50687-63-3 (Benzoic acid,4-hydroxy-, 4-ethoxyphenyl ester) Related Products
- 744-45-6(Diphenyl isophthalate)
- 93-44-7(naphthalen-2-yl benzoate)
- 93-99-2(Phenyl benzoate)
- 94-30-4(Ethyl 4-methoxybenzoate)
- 94-01-9(1,3-Dibenzoyloxybenzene)
- 2345-34-8(4-Acetoxybenzoic acid)
- 2150-37-0(Methyl 3,5-dimethoxybenzoate)
- 5368-81-0(Methyl 3-methoxybenzoate)
- 121-98-2(Methyl 4-methoxybenzoate)
- 1486-51-7(4-Benzyloxybenzoic acid)
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