C=C(C=O)CCCCCC
Name: 2-hexyl-2-propenal
SMILES: C=C(C=O)CCCCCC

Molecular Processing

Molecular formula
C9H16O
Molecular weight
140.23
Exact mass
140.1201
XLogP
2.71
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
10
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
0.667
Molar refractivity
43.96

Supplementary Information

Details werden geladen…

An 4 Reaktionen beteiligt