Home Halogens 2,6-dibromo-3-methyl-4-nitroanisole

2,6-dibromo-3-methyl-4-nitroanisole

CAS No.:
62265-99-0
Catalog Number:
AG00EDQZ
Molecular Formula:
C8H7Br2NO3
Molecular Weight:
324.9541
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Product Description
Catalog Number:
AG00EDQZ
Chemical Name:
2,6-dibromo-3-methyl-4-nitroanisole
CAS Number:
62265-99-0
Molecular Formula:
C8H7Br2NO3
Molecular Weight:
324.9541
MDL Number:
MFCD23099204
IUPAC Name:
1,3-dibromo-2-methoxy-4-methyl-5-nitrobenzene
InChI:
InChI=1S/C8H7Br2NO3/c1-4-6(11(12)13)3-5(9)8(14-2)7(4)10/h3H,1-2H3
InChI Key:
RBAJFFLBHVZCDY-UHFFFAOYSA-N
SMILES:
COc1c(Br)cc(c(c1Br)C)N(=O)=O
EC Number:
263-479-7
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.877g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
324.956g/mol
Monoisotopic Mass:
322.879g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties