Cas no 33905-62-3 (Benzoic acid,4-butoxy-, 4-hydroxyphenyl ester)
33905-62-3 structure
Product Name:Benzoic acid,4-butoxy-, 4-hydroxyphenyl ester
CAS No:33905-62-3
MF:C17H18O4
MW:286.322425365448
CID:304013
PubChem ID:53426758
Update Time:2025-04-19
Benzoic acid,4-butoxy-, 4-hydroxyphenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,4-butoxy-, 4-hydroxyphenyl ester
- (4-hydroxyphenyl) 4-butoxybenzoate
- 4-HYDROXYPHENYL 4-BUTOXYBENZOATE
- p-Hydroxyphenyl-p-n-butyloxybenzoate
- 4-Butoxy-benzoic acid 4-hydroxy-phenyl ester
- 33905-62-3
- DTXSID40699351
-
- Inchi： 1S/C17H18O4/c1-2-3-12-20-15-8-4-13(5-9-15)17(19)21-16-10-6-14(18)7-11-16/h4-11,18H,2-3,12H2,1H3
- InChI Key： YIWBRSAYFRNTMR-UHFFFAOYSA-N
- SMILES： O(C1C=CC(C(=O)OC2C=CC(=CC=2)O)=CC=1)CCCC
Computed Properties
- Exact Mass: 286.12100
- Monoisotopic Mass: 286.12050905g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 7
- Complexity: 302
- 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: 5.1
- Topological Polar Surface Area: 55.8?2
Experimental Properties
- PSA: 55.76000
- LogP: 3.79030
Benzoic acid,4-butoxy-, 4-hydroxyphenyl ester Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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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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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
33905-62-3 (Benzoic acid,4-butoxy-, 4-hydroxyphenyl ester) Related Products
- 744-45-6(Diphenyl isophthalate)
- 4906-25-6(Methyl 4-n-butoxybenzoate)
- 2444-19-1(4-Hydroxyphenyl benzoate)
- 62435-37-4(Methyl 4-n-octyloxybenzoate)
- 93-99-2(Phenyl benzoate)
- 1498-96-0(4-Butoxybenzoic acid)
- 28084-48-2(Benzoic acid,4-hydroxy-, 4-hydroxyphenyl ester)
- 28099-28-7(Benzoic acid,4-methoxy-, 4-hydroxyphenyl ester)
- 17696-62-7(Phenyl 4-hydroxybenzoate)
- 1539-04-4(1,4-diphenyl benzene-1,4-dicarboxylate)
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