Cas no 71177-53-2 (Benzoic acid,4-hydroxy-, tetradecyl ester)
71177-53-2 structure
Product Name:Benzoic acid,4-hydroxy-, tetradecyl ester
CAS No:71177-53-2
MF:C21H34O3
MW:334.49286699295
CID:574882
PubChem ID:328882
Update Time:2025-04-19
Benzoic acid,4-hydroxy-, tetradecyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,4-hydroxy-, tetradecyl ester
- tetradecyl 4-hydroxybenzoate
- AC1L73KZ
- AG-G-78623
- CTK5D3649
- NSC309824
- n-tetradecyl 4-hydroxybenzoate
- p-Hydroxybenzoic acid tetradecyl ester
- SureCN1041302
- Tetradecyl p-hydroxybenzoate
- DTXSID20316978
- SCHEMBL1041302
- DATMKDBMEZKPLP-UHFFFAOYSA-N
- 71177-53-2
- NSC-309824
-
- Inchi： 1S/C21H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-18-24-21(23)19-14-16-20(22)17-15-19/h14-17,22H,2-13,18H2,1H3
- InChI Key： DATMKDBMEZKPLP-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC(=CC=1)O)=O)CCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 334.25092
- Monoisotopic Mass: 334.25079494g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 24
- Rotatable Bond Count: 15
- Complexity: 296
- 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: 8.6
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.53
- LogP: 6.25010
Benzoic acid,4-hydroxy-, tetradecyl ester Related Literature
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
-
Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
71177-53-2 (Benzoic acid,4-hydroxy-, tetradecyl ester) Related Products
- 2664-60-0(Dodecyl 4-hydroxybenzoate)
- 94-13-3(Propylparaben)
- 94-26-8(Butylparaben)
- 1085-12-7(n-Heptyl 4-Hydroxybenzoate)
- 1034-01-1(Octyl gallate)
- 1166-52-5(Dodecyl gallate)
- 1219-38-1(N-Octyl 4-Hydroxybenzoate)
- 5153-25-3(2-Ethylhexyl 4-hydroxybenzoate)
- 6521-29-5(Pentyl Paraben)
- 1083-27-8(Hexyl 4-hydroxybenzoate)
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