Cas no 129581-35-7 (10-Pentadecenoic acid,2,3-dihydroxypropyl ester)
129581-35-7 structure
Product Name:10-Pentadecenoic acid,2,3-dihydroxypropyl ester
CAS No:129581-35-7
MF:C18H34O4
MW:314.460166454315
CID:140903
PubChem ID:6444000
Update Time:2025-04-19
10-Pentadecenoic acid,2,3-dihydroxypropyl ester Chemical and Physical Properties
Names and Identifiers
-
- 10-Pentadecenoic acid,2,3-dihydroxypropyl ester
- 2,3-dihydroxypropyl (E)-pentadec-10-enoate
- monopentadecenoin
- 2,3-dihydroxypropyl (10E)-pentadec-10-enoate
- 129581-35-7
-
- Inchi： 1S/C18H34O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18(21)22-16-17(20)15-19/h5-6,17,19-20H,2-4,7-16H2,1H3/b6-5+
- InChI Key： JZGMGGOBAGTAIR-AATRIKPKSA-N
- SMILES： O(CC(CO)O)C(CCCCCCCC/C=C/CCCC)=O
Computed Properties
- Exact Mass: 314.24582
- Monoisotopic Mass: 314.24571
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 16
- Complexity: 276
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.9
- Topological Polar Surface Area: 66.8
Experimental Properties
- Density: 0.988
- Boiling Point: 442.6°Cat760mmHg
- Flash Point: 147°C
- Refractive Index: 1.479
- PSA: 66.76
10-Pentadecenoic acid,2,3-dihydroxypropyl ester Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
129581-35-7 (10-Pentadecenoic acid,2,3-dihydroxypropyl ester) Related Products
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