Home Nitros 4-Methoxy-2-nitrobenzyl bromide

4-Methoxy-2-nitrobenzyl bromide

CAS No.:
57559-52-1
Catalog Number:
AG00EBPK
Molecular Formula:
C8H8BrNO3
Molecular Weight:
246.0580
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Product Description
Catalog Number:
AG00EBPK
Chemical Name:
4-Methoxy-2-nitrobenzyl bromide
CAS Number:
57559-52-1
Molecular Formula:
C8H8BrNO3
Molecular Weight:
246.0580
MDL Number:
MFCD05148455
IUPAC Name:
1-(bromomethyl)-4-methoxy-2-nitrobenzene
InChI:
InChI=1S/C8H8BrNO3/c1-13-7-3-2-6(5-9)8(4-7)10(11)12/h2-4H,5H2,1H3
InChI Key:
WZFGFNGYZZHELE-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)[N+](=O)[O-])CBr
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.969g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.06g/mol
Monoisotopic Mass:
244.969g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties