CCC(C)C(=O)O
CAS: 116-53-0
Nombre: 2-methylbutanoic acid
SMILES: CCC(C)C(=O)O

Molecular Processing

Molecular formula
C5H10O2
Molecular weight
102.13
Exact mass
102.0681
XLogP
1.12
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
7
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
27.09

Supplementary Information

InChIKey: WLAMNBDJUVNPJU-UHFFFAOYSA-N
Sinónimos
2-Methylbutanoic acid116-53-02-METHYLBUTYRIC ACIDDL-2-Methylbutyric acidButanoic acid, 2-methyl-Ethylmethylacetic acidMethylethylacetic acid2-Methybutyric acidalpha-Methylbutyric acidFEMA No. 2695DTXSID5021621PX7ZNN5GXKNSC-7304DTXCID301621CHEBI:37070RefChem:910087204-145-2209-982-7Methylbutyric acid2-Methyl butyric acid600-07-7Active valeric acidButyric acid, 2-methyl-(+/-)-2-Methylbutyric acid2-methyl-butanoic acidalpha-methyl butyric AcidNSC 73042-methyl-butyric acidMFCD00002669.alpha.-Methylbutyric acid
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