Cas no 875249-16-4 (Methyl 4-methyl-3-oxopentanoate)
875249-16-4 structure
Product Name:Methyl 4-methyl-3-oxopentanoate
CAS No:875249-16-4
MF:C7H12O3
MW:144.168382644653
CID:2182926
Update Time:2023-08-06
Methyl 4-methyl-3-oxopentanoate Chemical and Physical Properties
Names and Identifiers
-
- Methylisobutyrylacetate
- 2,4-dimethyl-3-oxopentanoate
- methyl 4-methyl-3-oxopentanoate
- Methyl isobutyrylacetate
- Methyl 4-methyl-3-oxovalerate
- 4-Methyl-3-oxovaleric Acid Methyl Ester
- Isobutyrylacetic Acid Methyl Ester
- Iso-butyryl methyl acetate
- methyl 4-methyl-3-oxo-pentanoate
- KSC237G2D
- methyl 4-methyl-3oxopentanoate
- Methyl4-Methyl-3-oxopentanoate
- methyl-4-methyl-3-oxopentanoate
- methyl 3-oxo-4-methylpentanoate
- Dimethyl-acetessigsaure-methyle
- Methyl 4-methyl-3-oxopentanoate
-
- Inchi： 1S/C7H12O3/c1-5(2)6(8)4-7(9)10-3/h5H,4H2,1-3H3
- InChI Key： HNNFDXWDCFCVDM-UHFFFAOYSA-N
- SMILES： O=C(CC(=O)OC)C(C)C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 138
- Topological Polar Surface Area: 43.4
Methyl 4-methyl-3-oxopentanoate Related Literature
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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