Home Nitros Benzene, 1-iodo-3-methyl-5-nitro-

Benzene, 1-iodo-3-methyl-5-nitro-

CAS No.:
123158-78-1
Catalog Number:
AG00HH6I
Molecular Formula:
C7H6INO2
Molecular Weight:
263.0325
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Product Description
Catalog Number:
AG00HH6I
Chemical Name:
Benzene, 1-iodo-3-methyl-5-nitro-
CAS Number:
123158-78-1
Molecular Formula:
C7H6INO2
Molecular Weight:
263.0325
MDL Number:
MFCD15144646
IUPAC Name:
1-iodo-3-methyl-5-nitrobenzene
InChI:
InChI=1S/C7H6INO2/c1-5-2-6(8)4-7(3-5)9(10)11/h2-4H,1H3
InChI Key:
VIGIBQJFOYFDSH-UHFFFAOYSA-N
SMILES:
Cc1cc(I)cc(c1)[N+](=O)[O-]
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.944g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.034g/mol
Monoisotopic Mass:
262.944g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties