Name: Name:(2S)-1-{[(4-bromophenyl)methoxy]carbonyl}pyrrolidine-2-carboxylic acid
Brand: Angene
SKU: AG01ALCY
Rating: 90 (10 reviews)

(2S)-1-{[(4-bromophenyl)methoxy]carbonyl}pyrrolidine-2-carboxylic acid

CAS No.:

144332-75-2

Catalog Number:

AG01ALCY

Molecular Formula:

C13H14BrNO4

Molecular Weight:

328.1586

Catalog Number:

AG01ALCY

Chemical Name:

(2S)-1-{[(4-bromophenyl)methoxy]carbonyl}pyrrolidine-2-carboxylic acid

CAS Number:

144332-75-2

Molecular Formula:

C13H14BrNO4

Molecular Weight:

328.1586

MDL Number:

MFCD28954326

IUPAC Name:

(2S)-1-[(4-bromophenyl)methoxycarbonyl]pyrrolidine-2-carboxylic acid

InChI:

InChI=1S/C13H14BrNO4/c14-10-5-3-9(4-6-10)8-19-13(18)15-7-1-2-11(15)12(16)17/h3-6,11H,1-2,7-8H2,(H,16,17)/t11-/m0/s1

InChI Key:

CGOZVRYXMLVHCE-NSHDSACASA-N

SMILES:

OC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(cc1)Br

Complexity:

342

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

327.011g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

328.162g/mol

Monoisotopic Mass:

327.011g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4