CCCCOC(=O)C=O
名称: glyoxalic acid butyl ester
SMILES: CCCCOC(=O)C=O

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
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

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