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Home > Nitro Compounds > 1408327-48-9
1408327-48-9 | 5-Methyl-2-nitro-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one
CAS No: 1408327-48-9 Catalog No: AG00HVY8 MDL No:MFCD22690143
Product Description
Catalog Number:
AG00HVY8
Chemical Name:
5-Methyl-2-nitro-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one
CAS Number:
1408327-48-9
Molecular Formula:
C7H8N4O3
Molecular Weight:
196.1634
MDL Number:
MFCD22690143
IUPAC Name:
5-methyl-2-nitro-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
InChI:
InChI=1S/C7H8N4O3/c1-9-2-3-10-5(7(9)12)4-6(8-10)11(13)14/h4H,2-3H2,1H3
InChI Key:
UCMRDSZKWYVAJE-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2n(n1)CCN(C2=O)C
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.06g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.166g/mol
Monoisotopic Mass:
196.06g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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