COC(=O)C1=CC(=CC(=C1)Br)S(=O)(=O)N
CAS: 1343983-13-0
Nombre: methyl 3-bromo-5-sulfamoylbenzoate
SMILES: COC(=O)C1=CC(=CC(=C1)Br)S(=O)(=O)N

Molecular Processing

Molecular formula
C8H8BrNO4S
Molecular weight
294.13
Exact mass
292.9357
XLogP
0.88
TPSA
86.46
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
56.85

Supplementary Information

InChIKey: FZNAQWBSGZYMQM-UHFFFAOYSA-N
Sinónimos
methyl 3-bromo-5-sulfamoylbenzoate1343983-13-0SCHEMBL19518886methyl3-bromo-5-sulfamoylbenzoateTDC98313GS1070AKOS013152288EN300-115507
Ver fuente →
Participa en 608 reacciones→

Busqueda Extendida

Busqueda de Subestructura→Busqueda de Similitud→