Name: Name:(S)-Methyl 5-oxo-1-((r)-1-phenylethyl)pyrrolidine-3-carboxylate
Brand: Angene
SKU: AG00IKBV
Rating: 90 (10 reviews)

(S)-Methyl 5-oxo-1-((r)-1-phenylethyl)pyrrolidine-3-carboxylate

CAS No.:

99735-46-3

Catalog Number:

AG00IKBV

Molecular Formula:

C14H17NO3

Molecular Weight:

247.2897

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Catalog Number:

AG00IKBV

Chemical Name:

(S)-Methyl 5-oxo-1-((r)-1-phenylethyl)pyrrolidine-3-carboxylate

CAS Number:

99735-46-3

Molecular Formula:

C14H17NO3

Molecular Weight:

247.2897

MDL Number:

MFCD20526323

IUPAC Name:

methyl (3S)-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate

InChI:

InChI=1S/C14H17NO3/c1-10(11-6-4-3-5-7-11)15-9-12(8-13(15)16)14(17)18-2/h3-7,10,12H,8-9H2,1-2H3/t10-,12+/m1/s1

InChI Key:

BENQIPNJLDAXAT-PWSUYJOCSA-N

SMILES:

COC(=O)[C@@H]1CN(C(=O)C1)[C@@H](c1ccccc1)C

Complexity:

323

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

247.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

247.294g/mol

Monoisotopic Mass:

247.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2