Cas no 64137-28-6 (2-Furantetradecanoic acid, methyl ester)
64137-28-6 structure
Product Name:2-Furantetradecanoic acid, methyl ester
CAS No:64137-28-6
MF:C19H32O3
MW:308.455586433411
CID:424915
PubChem ID:71380447
Update Time:2025-04-19
2-Furantetradecanoic acid, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Furantetradecanoic acid, methyl ester
- methyl 14-(furan-2-yl)tetradecanoate
- 64137-28-6
- DTXSID60802961
-
- Inchi： 1S/C19H32O3/c1-21-19(20)16-12-10-8-6-4-2-3-5-7-9-11-14-18-15-13-17-22-18/h13,15,17H,2-12,14,16H2,1H3
- InChI Key： RBCMJVCFUWJSHY-UHFFFAOYSA-N
- SMILES： O1C=CC=C1CCCCCCCCCCCCCC(=O)OC
Computed Properties
- Exact Mass: 308.23526
- Monoisotopic Mass: 308.23514488g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 22
- Rotatable Bond Count: 15
- Complexity: 265
- 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: 6.7
- Topological Polar Surface Area: 39.4?2
Experimental Properties
- PSA: 39.44
2-Furantetradecanoic acid, methyl ester Related Literature
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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