Name: p-(p-n-octylphenyl)-benzoic acid chloride
SMILES:
CCCCCCCCc1ccc(-c2ccc(C(=O)Cl)cc2)cc1Molecular Processing
Molecular formula
C21H25ClO
Molecular weight
328.88
Exact mass
328.1594
XLogP
6.64
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
9
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
99.14
Supplementary Information
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