C=CCOCC=C
SMILES: C=CCOCC=C

Molecular Processing

Molecular formula
C6H10O
Molecular weight
98.14
Exact mass
98.0732
XLogP
1.38
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
7
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
31.21

Supplementary Information

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