Name: Name:1,2-Piperidinedicarboxylic acid, 4-oxo-, 1-(1,1-dimethylethyl) 2-ethyl ester, (2S)-
Brand: Angene
SKU: AG0022ER
Rating: 90 (10 reviews)

1,2-Piperidinedicarboxylic acid, 4-oxo-, 1-(1,1-dimethylethyl) 2-ethyl ester, (2S)-

CAS No.:

180854-44-8

Catalog Number:

AG0022ER

Molecular Formula:

C13H21NO5

Molecular Weight:

271.3095

Catalog Number:

AG0022ER

Chemical Name:

1,2-Piperidinedicarboxylic acid, 4-oxo-, 1-(1,1-dimethylethyl) 2-ethyl ester, (2S)-

CAS Number:

180854-44-8

Molecular Formula:

C13H21NO5

Molecular Weight:

271.3095

MDL Number:

MFCD15071881

IUPAC Name:

1-O-tert-butyl 2-O-ethyl (2S)-4-oxopiperidine-1,2-dicarboxylate

InChI:

InChI=1S/C13H21NO5/c1-5-18-11(16)10-8-9(15)6-7-14(10)12(17)19-13(2,3)4/h10H,5-8H2,1-4H3/t10-/m0/s1

InChI Key:

YAVQLRUBKDCOCI-JTQLQIEISA-N

SMILES:

CCOC(=O)[C@@H]1CC(=O)CCN1C(=O)OC(C)(C)C

Complexity:

372

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

271.142g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

271.313g/mol

Monoisotopic Mass:

271.142g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9