Name: Name:1,2-Pyrrolidinedicarboxylic acid, 4,4-dimethyl-5-oxo-, 1-(1,1-dimethylethyl) 2-methyl ester, (2S)-
Brand: Angene
SKU: AG001Q59
Rating: 90 (10 reviews)

1,2-Pyrrolidinedicarboxylic acid, 4,4-dimethyl-5-oxo-, 1-(1,1-dimethylethyl) 2-methyl ester, (2S)-

CAS No.:

158392-74-6

Catalog Number:

AG001Q59

Molecular Formula:

C13H21NO5

Molecular Weight:

271.3095

Catalog Number:

AG001Q59

Chemical Name:

1,2-Pyrrolidinedicarboxylic acid, 4,4-dimethyl-5-oxo-, 1-(1,1-dimethylethyl) 2-methyl ester, (2S)-

CAS Number:

158392-74-6

Molecular Formula:

C13H21NO5

Molecular Weight:

271.3095

MDL Number:

MFCD09840931

IUPAC Name:

1-O-tert-butyl 2-O-methyl (2S)-4,4-dimethyl-5-oxopyrrolidine-1,2-dicarboxylate

InChI:

InChI=1S/C13H21NO5/c1-12(2,3)19-11(17)14-8(9(15)18-6)7-13(4,5)10(14)16/h8H,7H2,1-6H3/t8-/m0/s1

InChI Key:

BJPCXZMEJRLORA-QMMMGPOBSA-N

SMILES:

COC(=O)[C@@H]1CC(C(=O)N1C(=O)OC(C)(C)C)(C)C

Complexity:

408

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:

1.8