Name: 3,5-dichloro-4-(cyclopentyloxy)benzoic acid
SMILES:
O=C(O)c1cc(Cl)c(OC2CCCC2)c(Cl)c1Molecular Processing
Molecular formula
C12H12Cl2O3
Molecular weight
275.13
Exact mass
274.0163
XLogP
4.01
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
66.31
Supplementary Information
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