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Home > Nitro Compounds > 1255147-10-4
1255147-10-4 | (5-Nitropyridin-2-yl)cyanamide
CAS No: 1255147-10-4 Catalog No: AG00HI8D MDL No:MFCD17267859
Product Description
Catalog Number:
AG00HI8D
Chemical Name:
(5-Nitropyridin-2-yl)cyanamide
CAS Number:
1255147-10-4
Molecular Formula:
C6H4N4O2
Molecular Weight:
164.1216
MDL Number:
MFCD17267859
IUPAC Name:
(5-nitropyridin-2-yl)cyanamide
InChI:
InChI=1S/C6H4N4O2/c7-4-9-6-2-1-5(3-8-6)10(11)12/h1-3H,(H,8,9)
InChI Key:
CTFMVWRJNIZZEZ-UHFFFAOYSA-N
SMILES:
N#CNc1ccc(cn1)[N+](=O)[O-]
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.033g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.124g/mol
Monoisotopic Mass:
164.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
94.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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