Name: Name:1-Piperidinecarboxylic acid, 4-[[(methylsulfonyl)oxy]methyl]-, phenylmethyl ester
Brand: Angene
SKU: AG001QKC
Rating: 90 (10 reviews)

1-Piperidinecarboxylic acid, 4-[[(methylsulfonyl)oxy]methyl]-, phenylmethyl ester

CAS No.:

159275-16-8

Catalog Number:

AG001QKC

Molecular Formula:

C15H21NO5S

Molecular Weight:

327.3959

Catalog Number:

AG001QKC

Chemical Name:

1-Piperidinecarboxylic acid, 4-[[(methylsulfonyl)oxy]methyl]-, phenylmethyl ester

CAS Number:

159275-16-8

Molecular Formula:

C15H21NO5S

Molecular Weight:

327.3959

MDL Number:

MFCD06409219

IUPAC Name:

benzyl 4-(methylsulfonyloxymethyl)piperidine-1-carboxylate

InChI:

InChI=1S/C15H21NO5S/c1-22(18,19)21-12-14-7-9-16(10-8-14)15(17)20-11-13-5-3-2-4-6-13/h2-6,14H,7-12H2,1H3

InChI Key:

IEWBROJCHGYFSK-UHFFFAOYSA-N

SMILES:

O=C(N1CCC(CC1)COS(=O)(=O)C)OCc1ccccc1

Complexity:

445

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

327.114g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

327.395g/mol

Monoisotopic Mass:

327.114g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8