名称: 1-(5-chloro-1-hydroxynaphthalen-2-yl)-1-dodecanone
SMILES:
CCCCCCCCCCCC(=O)c1ccc2c(Cl)cccc2c1OMolecular Processing
Molecular formula
C22H29ClO2
Molecular weight
360.93
Exact mass
360.1856
XLogP
7.3
TPSA
37.3
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
11
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
106.8
Supplementary Information
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