이름: 6-octyloxy-2-naphthoic acid
SMILES:
CCCCCCCCOc1ccc2cc(C(=O)O)ccc2c1Molecular Processing
Molecular formula
C19H24O3
Molecular weight
300.4
Exact mass
300.1725
XLogP
5.28
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
9
Heavy atoms
22
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
0.421
Molar refractivity
89.78
Supplementary Information
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