Name: 2-(1-phenylcyclopentyl)acetaldehyde
SMILES:
O=CCC1(c2ccccc2)CCCC1Molecular Processing
Molecular formula
C13H16O
Molecular weight
188.27
Exact mass
188.1201
XLogP
3.09
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
57.27
Supplementary Information
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