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Home > Nitro Compounds > 1260885-20-8
1260885-20-8 | Benzonitrile, 2-hydrazinyl-4-nitro-, hydrochloride (1:1)
CAS No: 1260885-20-8 Catalog No: AG000RJA MDL No:
Product Description
Catalog Number:
AG000RJA
Chemical Name:
Benzonitrile, 2-hydrazinyl-4-nitro-, hydrochloride (1:1)
CAS Number:
1260885-20-8
Molecular Formula:
C7H7ClN4O2
Molecular Weight:
214.6091
IUPAC Name:
2-hydrazinyl-4-nitrobenzonitrile;hydrochloride
InChI:
InChI=1S/C7H6N4O2.ClH/c8-4-5-1-2-6(11(12)13)3-7(5)10-9;/h1-3,10H,9H2;1H
InChI Key:
FMKQTGRVLBPOQK-UHFFFAOYSA-N
SMILES:
NNc1cc(ccc1C#N)[N+](=O)[O-].Cl
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.026g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
214.609g/mol
Monoisotopic Mass:
214.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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