Name: Name:(2R,4R)-Benzyl 4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate
Brand: Angene
SKU: AG0096X8
Rating: 90 (10 reviews)

(2R,4R)-Benzyl 4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate

CAS No.:

1009335-39-0

Catalog Number:

AG0096X8

Molecular Formula:

C13H17NO4

Molecular Weight:

251.2784

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Purity

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United States

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Catalog Number:

AG0096X8

Chemical Name:

(2R,4R)-Benzyl 4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate

CAS Number:

1009335-39-0

Molecular Formula:

C13H17NO4

Molecular Weight:

251.2784

MDL Number:

MFCD18837818

IUPAC Name:

benzyl (2R,4R)-4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate

InChI:

InChI=1S/C13H17NO4/c15-8-11-6-12(16)7-14(11)13(17)18-9-10-4-2-1-3-5-10/h1-5,11-12,15-16H,6-9H2/t11-,12-/m1/s1

InChI Key:

WDEQGLDWZMIMJM-VXGBXAGGSA-N

SMILES:

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

Complexity:

278

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

251.116g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

251.282g/mol

Monoisotopic Mass:

251.116g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5