Name: Name:1-Piperidinecarboxylic acid, 4-(acetylthio)-, 1,1-diMethylethyl ester
Brand: Angene
SKU: AG00A9HV
Rating: 90 (10 reviews)

1-Piperidinecarboxylic acid, 4-(acetylthio)-, 1,1-diMethylethyl ester

CAS No.:

141699-66-3

Catalog Number:

AG00A9HV

Molecular Formula:

C12H21NO3S

Molecular Weight:

259.3650

Catalog Number:

AG00A9HV

Chemical Name:

1-Piperidinecarboxylic acid, 4-(acetylthio)-, 1,1-diMethylethyl ester

CAS Number:

141699-66-3

Molecular Formula:

C12H21NO3S

Molecular Weight:

259.3650

MDL Number:

MFCD13183580

IUPAC Name:

tert-butyl 4-acetylsulfanylpiperidine-1-carboxylate

InChI:

InChI=1S/C12H21NO3S/c1-9(14)17-10-5-7-13(8-6-10)11(15)16-12(2,3)4/h10H,5-8H2,1-4H3

InChI Key:

SJAKIGKVIJINMY-UHFFFAOYSA-N

SMILES:

CC(=O)SC1CCN(CC1)C(=O)OC(C)(C)C

Complexity:

291

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

259.124g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

259.364g/mol

Monoisotopic Mass:

259.124g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1