200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 831203-53-3
831203-53-3 | Piperidine, 1-(3-nitrophenyl)-4-(phenylmethyl)-
CAS No: 831203-53-3 Catalog No: AG0051JZ MDL No:
Product Description
Catalog Number:
AG0051JZ
Chemical Name:
Piperidine, 1-(3-nitrophenyl)-4-(phenylmethyl)-
CAS Number:
831203-53-3
Molecular Formula:
C18H20N2O2
Molecular Weight:
296.3636
IUPAC Name:
4-benzyl-1-(3-nitrophenyl)piperidine
InChI:
InChI=1S/C18H20N2O2/c21-20(22)18-8-4-7-17(14-18)19-11-9-16(10-12-19)13-15-5-2-1-3-6-15/h1-8,14,16H,9-13H2
InChI Key:
RPFRWDJZSYYHJI-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)N1CCC(CC1)Cc1ccccc1
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.152g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.37g/mol
Monoisotopic Mass:
296.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.