Cas no 131141-70-3 (Propanoic acid,2,2-dimethyl-, 2-ethylbutyl ester)
131141-70-3 structure
Product Name:Propanoic acid,2,2-dimethyl-, 2-ethylbutyl ester
CAS No:131141-70-3
MF:C11H22O2
MW:186.291183948517
CID:102409
PubChem ID:14710420
Update Time:2025-04-18
Propanoic acid,2,2-dimethyl-, 2-ethylbutyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid,2,2-dimethyl-, 2-ethylbutyl ester
- 4-methylpentyl 2,2-dimethylpropanoate
- ISOHEXYL NEOPENTANOATE
- Propanoic acid, 2-Methyl-, 2-ethylbutyl ester
- SCHEMBL13686673
- 131141-70-3
- 2-Ethylbutyl pivalate
- 2-Ethylbutyl 2,2-dimethylpropanoate
- Propanoic acid, 2,2-dimethyl-, 2-ethylbutyl ester
- DTXSID00338052
-
- Inchi： 1S/C11H22O2/c1-6-9(7-2)8-13-10(12)11(3,4)5/h9H,6-8H2,1-5H3
- InChI Key： ISMQKBKUZVGAES-UHFFFAOYSA-N
- SMILES： O(C(C(C)(C)C)=O)CC(CC)CC
Computed Properties
- Exact Mass: 186.161979940g/mol
- Monoisotopic Mass: 186.161979940g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 6
- Complexity: 152
- 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: 4
- Topological Polar Surface Area: 26.3?2
Propanoic acid,2,2-dimethyl-, 2-ethylbutyl ester Related Literature
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
131141-70-3 (Propanoic acid,2,2-dimethyl-, 2-ethylbutyl ester) Related Products
- 2349-07-7(Hexyl isobutyrate)
- 2050-01-3(Isoamyl Isobutyrate)
- 25265-77-4(Texanol)
- 39255-32-8(Ethyl 2-methylpentanoate)
- 10032-15-2(Hexyl 2-methylbutanoate)
- 2938-48-9(2,2-Dimethylglutaric anhydride)
- 90397-38-9(2-Methylpentyl 2-methylvalerate)
- 25550-51-0(Methylhexahydroisobenzofuran-1,3-Dione)
- 2094-73-7(1-Adamantylcarboxylic Acid Ethyl Ester)
- 2445-69-4(2-Methylbutyl isobutyrate)
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