COC1=C(C=C(C=C1)CBr)[N+](=O)[O-]
CAS: 61010-34-2
Name: 4-(bromomethyl)-1-methoxy-2-nitrobenzene
SMILES: COC1=C(C=C(C=C1)CBr)[N+](=O)[O-]

Molecular Processing

Molecular formula
C8H8BrNO3
Molecular weight
246.06
Exact mass
244.9688
XLogP
2.5
TPSA
52.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
13
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
0.25
Molar refractivity
52.28

Supplementary Information

InChIKey: WRNURTUGHOTMMX-UHFFFAOYSA-N
Synonyme
4-(bromomethyl)-1-methoxy-2-nitrobenzeneRefChem:515323961-831-061010-34-24-Methoxy-3-nitrobenzyl bromide3-Nitro-4-methoxybenzyl bromideMFCD03840698Benzene, 4-(bromomethyl)-1-methoxy-2-nitro-4-(bromomethyl)-1-methoxy-2-nitro-benzeneSCHEMBL97957SCHEMBL21449063-nitro4-methoxy benzyl bromide4-(Bromomethyl)-2-nitroanisoleDTXSID904688973-nitro-4-methoxy benzyl bromide4-methoxy-3-nitro benzyl bromideWRNURTUGHOTMMX-UHFFFAOYSA-NCS-M2726AKOS009310167AB165034-Bromomethyl-1-methoxy-2-nitro-benzeneAC-12068CS-13192SY020203EN300-236441F222208F2147-0708
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