CCC(=O)CC(=O)OC
CAS: 30414-53-0
Nombre: methyl 3-oxopentanoate
SMILES: CCC(=O)CC(=O)OC

Molecular Processing

Molecular formula
C6H10O3
Molecular weight
130.14
Exact mass
130.063
XLogP
0.53
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
31.93

Supplementary Information

InChIKey: XJMIXEAZMCTAGH-UHFFFAOYSA-N
Sinónimos
Methyl 3-oxovalerateMethyl 3-oxopentanoate30414-53-0Pentanoic acid, 3-oxo-, methyl ester3-Oxovaleric Acid Methyl Ester3-oxopentanoic acid methyl esterMethyl 3-oxo-n-valerateValeric acid, 3-oxo-, methyl esterY9CQ6VT8U5EINECS 250-184-3XJMIXEAZMCTAGH-UHFFFAOYSA-DTXSID40184499EC 250-184-3RefChem:157530DTXCID00106990250-184-3InChI=1/C6H10O3/c1-3-5(7)4-6(8)9-2/h3-4H2,1-2H3XJMIXEAZMCTAGH-UHFFFAOYSA-NMethyl propionylacetateMFCD000117053-oxo-pentanoic acid methyl esterMethyl .beta.-ketovalerate3-keto-n-valeric acid methyl esterMethyl 3-Oxo-PentanoateMethyl3-oxovaleratePropionylacetic Acid Methyl Estermethyl-3-oxovaleratemethyl 3-ketovaleratemethyl 3-oxo-valeratemethyl 3-ketopentanoate
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