CAS 4289-95-6 | N-FORMYL-DL-PHENYLALANINE | CAS Number 4289-95-6

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4289-95-6 | N-FORMYL-DL-PHENYLALANINE

CAS No: 4289-95-6 Catalog No: AG003T1C MDL No:MFCD00063281

Product Description

Catalog Number:

AG003T1C

Chemical Name:

N-FORMYL-DL-PHENYLALANINE

CAS Number:

4289-95-6

Molecular Formula:

C10H11NO3

Molecular Weight:

193.1992

MDL Number:

MFCD00063281

IUPAC Name:

2-formamido-3-phenylpropanoic acid

InChI:

InChI=1S/C10H11NO3/c12-7-11-9(10(13)14)6-8-4-2-1-3-5-8/h1-5,7,9H,6H2,(H,11,12)(H,13,14)

InChI Key:

NSTPXGARCQOSAU-UHFFFAOYSA-N

SMILES:

O=CNC(C(=O)O)Cc1ccccc1

NSC Number:

334342

Properties

Complexity:

200

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

193.074g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

193.202g/mol

Monoisotopic Mass:

193.074g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501