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Home > Nitro Compounds > 870888-37-2
870888-37-2 | Piperidine, 1-(4-nitro-1-naphthalenyl)-4-(1-pyrrolidinyl)-
CAS No: 870888-37-2 Catalog No: AG004PNT MDL No:
Product Description
Catalog Number:
AG004PNT
Chemical Name:
Piperidine, 1-(4-nitro-1-naphthalenyl)-4-(1-pyrrolidinyl)-
CAS Number:
870888-37-2
Molecular Formula:
C19H23N3O2
Molecular Weight:
325.4048
IUPAC Name:
1-(4-nitronaphthalen-1-yl)-4-pyrrolidin-1-ylpiperidine
InChI:
InChI=1S/C19H23N3O2/c23-22(24)19-8-7-18(16-5-1-2-6-17(16)19)21-13-9-15(10-14-21)20-11-3-4-12-20/h1-2,5-8,15H,3-4,9-14H2
InChI Key:
PLPMLPFOKWSPJI-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c2c1cccc2)N1CCC(CC1)N1CCCC1
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.179g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.412g/mol
Monoisotopic Mass:
325.179g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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