COC1=CC(=C(C=C1)Br)[N+](=O)[O-]
CAS: 5344-78-5
Nombre: 1-bromo-4-methoxy-2-nitrobenzene
SMILES: COC1=CC(=C(C=C1)Br)[N+](=O)[O-]

Molecular Processing

Molecular formula
C7H6BrNO3
Molecular weight
232.03
Exact mass
230.9531
XLogP
2.37
TPSA
52.37
H-bond donors
0
H-bond acceptors
3
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
5
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
47.35

Supplementary Information

InChIKey: KCOBIBRGPCFIGF-UHFFFAOYSA-N
Sinónimos
4-Bromo-3-nitroanisole5344-78-51-Bromo-4-methoxy-2-nitrobenzeneEINECS 226-290-0DTXSID90201605NSC 1161RefChem:520015DTXCID80124096226-290-0Benzene, 1-bromo-4-methoxy-2-nitro-4-Bromo-3-nitroanisolMFCD000515111-Bromo-4-methoxy-2-nitro-benzene4-BROMO-3-NITROPHENYL METHYL ETHER3-NITRO-4-BROMOANISOLENSC11614-bromo-5-nitroanisole:4-Bromo-3-nitroanisoleSCHEMBL63202-bromo-5-methoxynitrobenzene4-Bromo-3-nitroanisole, 97%SCHEMBL12992246SCHEMBL30585356ALBB-016134NSC-1161CX1262SBB0099741-Bromo-4-methoxy-2-nitrobenzene #AKOS015835194AB02121
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