COC1=C(N=C(C=C1)[N+](=O)[O-])Br
CAS: 76066-07-4
Nom: 2-bromo-3-methoxy-6-nitropyridine
SMILES: COC1=C(N=C(C=C1)[N+](=O)[O-])Br

Molecular Processing

Molecular formula
C6H5BrN2O3
Molecular weight
233.02
Exact mass
231.9484
XLogP
1.76
TPSA
65.26
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
45.14

Supplementary Information

InChIKey: ZKEAOLVGPKCNCT-UHFFFAOYSA-N
Synonymes
2-bromo-3-methoxy-6-nitropyridine76066-07-42-Bromo-3-methoxy-6-nitro-pyridinePyridine, 2-bromo-3-methoxy-6-nitro-MFCD06662266SCHEMBL2031745DTXSID90507098ZKEAOLVGPKCNCT-UHFFFAOYSA-NAB6410AKOS015835841AB26771AS-5275SY103844DB-075059CS-0038866EN300-118162F225496F2108-0106
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Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→