Name: Name:1-Piperidinecarboxylic acid, 4-nitro-, phenylmethyl ester
Brand: Angene
SKU: AG000TCS
Rating: 90 (10 reviews)

1-Piperidinecarboxylic acid, 4-nitro-, phenylmethyl ester

CAS No.:

1268520-00-8

Catalog Number:

AG000TCS

Molecular Formula:

C13H16N2O4

Molecular Weight:

264.2771

Catalog Number:

AG000TCS

Chemical Name:

1-Piperidinecarboxylic acid, 4-nitro-, phenylmethyl ester

CAS Number:

1268520-00-8

Molecular Formula:

C13H16N2O4

Molecular Weight:

264.2771

MDL Number:

MFCD18633013

IUPAC Name:

benzyl 4-nitropiperidine-1-carboxylate

InChI:

InChI=1S/C13H16N2O4/c16-13(19-10-11-4-2-1-3-5-11)14-8-6-12(7-9-14)15(17)18/h1-5,12H,6-10H2

InChI Key:

KGKFRBBNVOEUCI-UHFFFAOYSA-N

SMILES:

O=C(N1CCC(CC1)[N+](=O)[O-])OCc1ccccc1

Complexity:

315

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

264.111g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

264.281g/mol

Monoisotopic Mass:

264.111g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9