C1CC2=C(C=CC(=C2)O)OC1C3=CC(=CC=C3)Br
Name: 2-(3-bromophenyl)-3,4-dihydro-2H-chromen-6-ol
SMILES: C1CC2=C(C=CC(=C2)O)OC1C3=CC(=CC=C3)Br

Molecular Processing

Molecular formula
C15H13BrO2
Molecular weight
305.17
Exact mass
304.0099
XLogP
4.22
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
73.94

Supplementary Information

InChIKey: OFVGJRFFTRZUST-UHFFFAOYSA-N
Synonyme
SCHEMBL43681872-(3-Bromophenyl)chroman-6-olOFVGJRFFTRZUST-UHFFFAOYSA-N
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