CAS: 136831-95-3
Название: 2-oxoethyl butanoate
SMILES:
CCCC(=O)OCC=OMolecular 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
4
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: YEBNSRBQIIWQQC-UHFFFAOYSA-N
Синонимы
2-oxoethyl butyrate136831-95-32-oxoethyl Butanoate2-oxoethylbutanoatestarbld0009496SCHEMBL1843295SCHEMBL6219081YEBNSRBQIIWQQC-UHFFFAOYSA-N
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