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Home > Nitro Compounds > 4110-33-2
4110-33-2 | 2,4-Dinitrobenzonitrile
CAS No: 4110-33-2 Catalog No: AG003FV0 MDL No:MFCD00465665
Product Description
Catalog Number:
AG003FV0
Chemical Name:
2,4-Dinitrobenzonitrile
CAS Number:
4110-33-2
MDL Number:
MFCD00465665
IUPAC Name:
2,4-dinitrobenzonitrile
InChI:
InChI=1S/C7H3N3O4/c8-4-5-1-2-6(9(11)12)3-7(5)10(13)14/h1-3H
InChI Key:
KCUDEOWPXBMDJE-UHFFFAOYSA-N
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.012g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.118g/mol
Monoisotopic Mass:
193.012g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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