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Home > Nitro Compounds > 209482-01-9
209482-01-9 | Piperazine, 1-(2-methoxy-4-nitrophenyl)-4-methyl-
CAS No: 209482-01-9 Catalog No: AG002K99 MDL No:MFCD13192253
Product Description
Catalog Number:
AG002K99
Chemical Name:
Piperazine, 1-(2-methoxy-4-nitrophenyl)-4-methyl-
CAS Number:
209482-01-9
Molecular Formula:
C12H17N3O3
Molecular Weight:
251.2817
MDL Number:
MFCD13192253
IUPAC Name:
1-(2-methoxy-4-nitrophenyl)-4-methylpiperazine
InChI:
InChI=1S/C12H17N3O3/c1-13-5-7-14(8-6-13)11-4-3-10(15(16)17)9-12(11)18-2/h3-4,9H,5-8H2,1-2H3
InChI Key:
PCDGXHKODGQGON-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1N1CCN(CC1)C)[N+](=O)[O-]
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.127g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.286g/mol
Monoisotopic Mass:
251.127g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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