Name: Name:1,2-Pyrrolidinedicarboxylic acid, 4-hydroxy-, 2-methyl 1-(phenylmethyl) ester, (2R,4R)-
Brand: Angene
SKU: AG001NLB
Rating: 90 (10 reviews)

1,2-Pyrrolidinedicarboxylic acid, 4-hydroxy-, 2-methyl 1-(phenylmethyl) ester, (2R,4R)-

CAS No.:

155075-23-3

Catalog Number:

AG001NLB

Molecular Formula:

C14H17NO5

Molecular Weight:

279.2885

Catalog Number:

AG001NLB

Chemical Name:

1,2-Pyrrolidinedicarboxylic acid, 4-hydroxy-, 2-methyl 1-(phenylmethyl) ester, (2R,4R)-

CAS Number:

155075-23-3

Molecular Formula:

C14H17NO5

Molecular Weight:

279.2885

MDL Number:

MFCD09954933

IUPAC Name:

1-O-benzyl 2-O-methyl (2R,4R)-4-hydroxypyrrolidine-1,2-dicarboxylate

InChI:

InChI=1S/C14H17NO5/c1-19-13(17)12-7-11(16)8-15(12)14(18)20-9-10-5-3-2-4-6-10/h2-6,11-12,16H,7-9H2,1H3/t11-,12-/m1/s1

InChI Key:

VVKAGQHUUDRPOI-VXGBXAGGSA-N

SMILES:

COC(=O)[C@H]1C[C@H](CN1C(=O)OCc1ccccc1)O

Complexity:

354

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

279.111g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

279.292g/mol

Monoisotopic Mass:

279.111g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

76.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1