SMILES:
CC(=CCCC#Cc1ccccc1)C(=O)OMolecular Processing
Molecular formula
C14H14O2
Molecular weight
214.26
Exact mass
214.0994
XLogP
2.85
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
63.95
Supplementary Information
Récupération des détails…
Impliqué dans 1 réactions→