Name: 5-Bromo-3-formyl-4-methoxybenzoic acid
SMILES:
COc1c(Br)cc(C(=O)O)cc1C=OMolecular Processing
Molecular formula
C9H7BrO4
Molecular weight
259.06
Exact mass
257.9528
XLogP
1.97
TPSA
63.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
53.04
Supplementary Information
Details werden geladen…
An 5 Reaktionen beteiligt→