Nom: 5-Phenylpent-4-ynal
SMILES:
O=CCCC#Cc1ccccc1Molecular Processing
Molecular formula
C11H10O
Molecular weight
158.2
Exact mass
158.0732
XLogP
2.02
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
48.62
Supplementary Information
Récupération des détails…
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