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123158-76-9 | Benzene, 1-chloro-3-iodo-5-nitro-
CAS No: 123158-76-9 Catalog No: AG000K2W MDL No:MFCD13194575
Product Description
Catalog Number:
AG000K2W
Chemical Name:
Benzene, 1-chloro-3-iodo-5-nitro-
CAS Number:
123158-76-9
Molecular Formula:
C6H3ClINO2
Molecular Weight:
283.4510
MDL Number:
MFCD13194575
IUPAC Name:
1-chloro-3-iodo-5-nitrobenzene
InChI:
InChI=1S/C6H3ClINO2/c7-4-1-5(8)3-6(2-4)9(10)11/h1-3H
InChI Key:
MHCNYROPQXSCSQ-UHFFFAOYSA-N
SMILES:
Clc1cc(I)cc(c1)[N+](=O)[O-]
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.89g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.449g/mol
Monoisotopic Mass:
282.89g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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