Cas no 51815-08-8 (Pentadecanoic acid,1-methylethyl ester)
51815-08-8 structure
Product Name:Pentadecanoic acid,1-methylethyl ester
CAS No:51815-08-8
MF:C18H36O2
MW:284.477246284485
CID:372487
PubChem ID:103978
Update Time:2025-04-19
Pentadecanoic acid,1-methylethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Pentadecanoic acid,1-methylethyl ester
- isopropyl pentadecanoate
- propan-2-yl pentadecanoate
- 51815-08-8
- Pentadecanoic acid, isopropyl ester
- Pentadecanoic acid, 1-methylethyl ester
- DTXSID00199766
- KPHRUIGNOVAUSA-UHFFFAOYSA-N
- NS00022281
- EINECS 257-441-9
- SCHEMBL317117
-
- Inchi： 1S/C18H36O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18(19)20-17(2)3/h17H,4-16H2,1-3H3
- InChI Key： KPHRUIGNOVAUSA-UHFFFAOYSA-N
- SMILES： O(C(C)C)C(CCCCCCCCCCCCCC)=O
Computed Properties
- Exact Mass: 284.27168
- Monoisotopic Mass: 284.271530387g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 15
- Complexity: 212
- 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: nothing
- XLogP3: 7.7
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
Pentadecanoic acid,1-methylethyl ester Related Literature
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
-
Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
51815-08-8 (Pentadecanoic acid,1-methylethyl ester) Related Products
- 110-38-3(Ethyl decanoate)
- 110-40-7(Diethyl decanedioate)
- 104-50-7(4-Octanolide)
- 104-67-6(4-Undecanolide)
- 106-32-1(Ethyl n-Caprylate)
- 106-02-5(ω-Pentadecalactone)
- 106-30-9(Ethyl Heptanoate(Heptanoic Acid Ethyl Ester))
- 106-33-2(Ethyl Laurate(Ethyl Dodecanoate))
- 109-43-3(dibutyl sebacate)
- 123-29-5(Ethyl nonanoate)
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