Home Nitros 1-Bromo-4-iodo-5-methyl-2-nitrobenzene

1-Bromo-4-iodo-5-methyl-2-nitrobenzene

CAS No.:
1160573-63-6
Catalog Number:
AG01E5PT
Molecular Formula:
C7H5BrINO2
Molecular Weight:
341.9286
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Product Description
Catalog Number:
AG01E5PT
Chemical Name:
1-Bromo-4-iodo-5-methyl-2-nitrobenzene
CAS Number:
1160573-63-6
Molecular Formula:
C7H5BrINO2
Molecular Weight:
341.9286
MDL Number:
MFCD11846025
IUPAC Name:
1-bromo-4-iodo-5-methyl-2-nitrobenzene
InChI:
InChI=1S/C7H5BrINO2/c1-4-2-5(8)7(10(11)12)3-6(4)9/h2-3H,1H3
InChI Key:
OORCPJADBMDQNC-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(I)c(cc1Br)C
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.855g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.93g/mol
Monoisotopic Mass:
340.855g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties