Cas no 2380-30-5 (Octadecanoic acid,15-oxo-, methyl ester)
2380-30-5 structure
Product Name:Octadecanoic acid,15-oxo-, methyl ester
Octadecanoic acid,15-oxo-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Octadecanoic acid,15-oxo-, methyl ester
- Methyl 15-oxooctadecanoate
- Octadecanoic acid, 15-oxo-, methyl ester
- WGCRNNZFROMDJH-UHFFFAOYSA-N
- DTXSID10336983
- Methyl 15-oxooctadecanoate #
- 2380-30-5
-
- Inchi： 1S/C19H36O3/c1-3-15-18(20)16-13-11-9-7-5-4-6-8-10-12-14-17-19(21)22-2/h3-17H2,1-2H3
- InChI Key： WGCRNNZFROMDJH-UHFFFAOYSA-N
- SMILES： O=C(CCC)CCCCCCCCCCCCCC(=O)OC
Computed Properties
- Exact Mass: 312.26658
- Monoisotopic Mass: 312.26644501g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 22
- Rotatable Bond Count: 17
- Complexity: 274
- 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
- Surface Charge: 0
- Tautomer Count: 3
- XLogP3: 6.1
- Topological Polar Surface Area: 43.4?2
Experimental Properties
- PSA: 43.37
Octadecanoic acid,15-oxo-, methyl ester Related Literature
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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