Name: Name:L-Proline, 1-(4-cyanophenyl)-
Brand: Angene
SKU: AG000Z27
Rating: 90 (10 reviews)

L-Proline, 1-(4-cyanophenyl)-

CAS No.:

129297-52-5

Catalog Number:

AG000Z27

Molecular Formula:

C12H12N2O2

Molecular Weight:

216.2359

Catalog Number:

AG000Z27

Chemical Name:

L-Proline, 1-(4-cyanophenyl)-

CAS Number:

129297-52-5

Molecular Formula:

C12H12N2O2

Molecular Weight:

216.2359

MDL Number:

MFCD09757500

IUPAC Name:

(2S)-1-(4-cyanophenyl)pyrrolidine-2-carboxylic acid

InChI:

InChI=1S/C12H12N2O2/c13-8-9-3-5-10(6-4-9)14-7-1-2-11(14)12(15)16/h3-6,11H,1-2,7H2,(H,15,16)/t11-/m0/s1

InChI Key:

QXPDICRRGHNHKO-NSHDSACASA-N

SMILES:

N#Cc1ccc(cc1)N1CCC[C@H]1C(=O)O

Complexity:

312

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

216.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

216.24g/mol

Monoisotopic Mass:

216.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9