名称: 6-Bromomethyl-1-oxo-3-phenyl-1H-indene-2-carboxylate ethyl ester
SMILES:
CCOC(=O)C1=C(c2ccccc2)c2ccc(CBr)cc2C1=OMolecular Processing
Molecular formula
C19H15BrO3
Molecular weight
371.23
Exact mass
370.0205
XLogP
4.14
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
23
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
0.158
Molar refractivity
92.5
Supplementary Information
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