Название: 3-Bromo-6H-benzo[c]chromene-8-carboxylic acid methyl ester
SMILES:
COC(=O)c1ccc2c(c1)COc1cc(Br)ccc1-2Molecular Processing
Molecular formula
C15H11BrO3
Molecular weight
319.15
Exact mass
317.9892
XLogP
3.8
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
75.25
Supplementary Information
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