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Home > Nitro Compounds > 880-83-1
880-83-1 | 6-hydrazinyl-3-methyl-5-nitropyrimidine-2,4(3h,5h)-dione
CAS No: 880-83-1 Catalog No: AG004ERA MDL No:
Product Description
Catalog Number:
AG004ERA
Chemical Name:
6-hydrazinyl-3-methyl-5-nitropyrimidine-2,4(3h,5h)-dione
CAS Number:
880-83-1
Molecular Formula:
C5H7N5O4
Molecular Weight:
201.1402
IUPAC Name:
(6Z)-6-hydrazinylidene-3-methyl-5-nitro-1,3-diazinane-2,4-dione
InChI:
InChI=1S/C5H7N5O4/c1-9-4(11)2(10(13)14)3(8-6)7-5(9)12/h2H,6H2,1H3,(H,7,8,12)
InChI Key:
JEXYXVFIUHVCTR-UHFFFAOYSA-N
SMILES:
NNC1=NC(=O)N(C(=O)C1[N+](=O)[O-])C
NSC Number:
78732
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
201.05g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
201.142g/mol
Monoisotopic Mass:
201.05g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
134A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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