Cas no 69679-31-8 (Benzoicacid, 4-hydroxy-, undecyl ester)
69679-31-8 structure
Product Name:Benzoicacid, 4-hydroxy-, undecyl ester
CAS No:69679-31-8
MF:C18H28O3
MW:292.413125991821
CID:529750
PubChem ID:328880
Update Time:2025-04-19
Benzoicacid, 4-hydroxy-, undecyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoicacid, 4-hydroxy-, undecyl ester
- undecyl 4-hydroxybenzoate
- NSC 309821
- NSC309821
- NSC-309821
- DTXSID00316976
- SCHEMBL18187564
- 69679-31-8
-
- Inchi： 1S/C18H28O3/c1-2-3-4-5-6-7-8-9-10-15-21-18(20)16-11-13-17(19)14-12-16/h11-14,19H,2-10,15H2,1H3
- InChI Key： VNHZHSYTJBADIV-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC(=CC=1)O)=O)CCCCCCCCCCC
Computed Properties
- Exact Mass: 292.20394
- Monoisotopic Mass: 292.20384475g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 12
- Complexity: 257
- 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: 7
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.53
Benzoicacid, 4-hydroxy-, undecyl ester Related Literature
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
69679-31-8 (Benzoicacid, 4-hydroxy-, undecyl 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)
- 1083-27-8(Hexyl 4-hydroxybenzoate)
- 6969-49-9(Octyl salicylate)
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