Name: Name:(S)-Benzyl 3-carbamoylpyrrolidine-1-carboxylate
Brand: Angene
SKU: AG003CJU
Rating: 90 (10 reviews)

(S)-Benzyl 3-carbamoylpyrrolidine-1-carboxylate

CAS No.:

573704-57-1

Catalog Number:

AG003CJU

Molecular Formula:

C13H16N2O3

Molecular Weight:

248.2777

Catalog Number:

AG003CJU

Chemical Name:

(S)-Benzyl 3-carbamoylpyrrolidine-1-carboxylate

CAS Number:

573704-57-1

Molecular Formula:

C13H16N2O3

Molecular Weight:

248.2777

MDL Number:

MFCD18071036

IUPAC Name:

benzyl (3S)-3-carbamoylpyrrolidine-1-carboxylate

InChI:

InChI=1S/C13H16N2O3/c14-12(16)11-6-7-15(8-11)13(17)18-9-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H2,14,16)/t11-/m0/s1

InChI Key:

RFMDNYSGEQPCAA-NSHDSACASA-N

SMILES:

NC(=O)[C@H]1CCN(C1)C(=O)OCc1ccccc1

Complexity:

313

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

248.116g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

248.282g/mol

Monoisotopic Mass:

248.116g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6