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Home > Nitro Compounds > 863713-30-8
863713-30-8 | Piperazine, 3-methyl-1-(3-nitro-2-pyridinyl)-, (3R)-
CAS No: 863713-30-8 Catalog No: AG004IFO MDL No:
Product Description
Catalog Number:
AG004IFO
Chemical Name:
Piperazine, 3-methyl-1-(3-nitro-2-pyridinyl)-, (3R)-
CAS Number:
863713-30-8
Molecular Formula:
C10H14N4O2
Molecular Weight:
222.2438
IUPAC Name:
(3R)-3-methyl-1-(3-nitropyridin-2-yl)piperazine
InChI:
InChI=1S/C10H14N4O2/c1-8-7-13(6-5-11-8)10-9(14(15)16)3-2-4-12-10/h2-4,8,11H,5-7H2,1H3/t8-/m1/s1
InChI Key:
JRVIFHPFNSWJLO-MRVPVSSYSA-N
SMILES:
C[C@H]1NCCN(C1)c1ncccc1[N+](=O)[O-]
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
222.112g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.248g/mol
Monoisotopic Mass:
222.112g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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