C1C(C2=C(C=CC(=C2)O)OC1C3=C(C=CC=C3F)F)O
Name: 2-(2,6-difluorophenyl)-3,4-dihydro-2H-chromene-4,6-diol
SMILES: C1C(C2=C(C=CC(=C2)O)OC1C3=C(C=CC=C3F)F)O

Molecular Processing

Molecular formula
C15H12F2O3
Molecular weight
278.25
Exact mass
278.0755
XLogP
3.23
TPSA
49.69
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
67.41

Supplementary Information

InChIKey: GJJNUSMQLBBGLR-UHFFFAOYSA-N
Synonyme
SCHEMBL4360575GJJNUSMQLBBGLR-UHFFFAOYSA-N2-(2,6-Difluorophenyl)chroman-4,6-diol
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