Name: (1-oxo-2-ethyl-3-methyl-6,7-dichloro-5-indanyloxy)acetic acid
SMILES:
CCC1C(=O)c2c(cc(OCC(=O)O)c(Cl)c2Cl)C1CMolecular Processing
Molecular formula
C14H14Cl2O4
Molecular weight
317.17
Exact mass
316.0269
XLogP
3.78
TPSA
63.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
76.12
Supplementary Information
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