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Home > Nitro Compounds > 100070-64-2
100070-64-2 | 2H-Pyrido[1,2-a]pyrazine, octahydro-2-nitro-
CAS No: 100070-64-2 Catalog No: AG0000T0 MDL No:
Product Description
Catalog Number:
AG0000T0
Chemical Name:
2H-Pyrido[1,2-a]pyrazine, octahydro-2-nitro-
CAS Number:
100070-64-2
Molecular Formula:
C8H15N3O2
Molecular Weight:
185.2236
IUPAC Name:
2-nitro-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
InChI:
InChI=1S/C8H15N3O2/c12-11(13)10-6-5-9-4-2-1-3-8(9)7-10/h8H,1-7H2
InChI Key:
MUAVZUTYGUEGNH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)N1CCN2C(C1)CCCC2
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.116g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.227g/mol
Monoisotopic Mass:
185.116g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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