CAS 126109-42-0 | L-Phenylalanine, 4-carboxy- | CAS Number 126109-42-0

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126109-42-0 | L-Phenylalanine, 4-carboxy-

CAS No: 126109-42-0 Catalog No: AG000RNH MDL No:MFCD01318768

Product Description

Catalog Number:

AG000RNH

Chemical Name:

L-Phenylalanine, 4-carboxy-

CAS Number:

126109-42-0

Molecular Formula:

C10H11NO4

Molecular Weight:

209.1986

MDL Number:

MFCD01318768

IUPAC Name:

4-[(2S)-2-amino-2-carboxyethyl]benzoic acid

InChI:

InChI=1S/C10H11NO4/c11-8(10(14)15)5-6-1-3-7(4-2-6)9(12)13/h1-4,8H,5,11H2,(H,12,13)(H,14,15)/t8-/m0/s1

InChI Key:

YXDGRBPZVQPESQ-QMMMGPOBSA-N

SMILES:

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

Properties

Complexity:

246

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

209.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

209.201g/mol

Monoisotopic Mass:

209.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

101A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.6

Literature

Title	Journal
Enantioselective HPLC of potentially CNS-active acidic amino acids with a Cinchona carbamate based chiral stationary phase.	Chirality 20080301
New chromogenic substrates of human neutrophil cathepsin G containing non-natural aromatic amino acid residues in position P(1) selected by combinatorial chemistry methods.	Molecular diversity 20070501
Effect of carboxylation of N-terminal phenylalanine of (111)in-DTPA (diethylenetriaminepentaacetic acid)-octreotide on accumulation of radioactivity in kidney.	Biological & pharmaceutical bulletin 20040201