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18162-00-0 | Hydrazinecarboxamide, 2-[2-(3,4-dihydro-5-nitro-2,4-dioxo-1(2H)-pyrimidinyl)ethylidene]-
CAS No: 18162-00-0 Catalog No: AG0022YH MDL No:
Product Description
Catalog Number:
AG0022YH
Chemical Name:
Hydrazinecarboxamide, 2-[2-(3,4-dihydro-5-nitro-2,4-dioxo-1(2H)-pyrimidinyl)ethylidene]-
CAS Number:
18162-00-0
Molecular Formula:
C7H8N6O5
Molecular Weight:
256.1756
IUPAC Name:
[2-(5-nitro-2,4-dioxopyrimidin-1-yl)ethylideneamino]urea
InChI:
InChI=1S/C7H8N6O5/c8-6(15)11-9-1-2-12-3-4(13(17)18)5(14)10-7(12)16/h1,3H,2H2,(H3,8,11,15)(H,10,14,16)
InChI Key:
JQVWNPMCWBAFKT-UHFFFAOYSA-N
SMILES:
NC(=O)NN=CCn1cc([N+](=O)[O-])c(=O)[nH]c1=O
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.056g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
256.178g/mol
Monoisotopic Mass:
256.056g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
163A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
-2
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