이름: 2-(3-chlorophenyl)-acetaldehyde
SMILES:
O=CCc1cccc(Cl)c1Molecular Processing
Molecular formula
C8H7ClO
Molecular weight
154.6
Exact mass
154.0185
XLogP
2.08
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
10
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
0.125
Molar refractivity
41.22
Supplementary Information
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