85317-52-8 | 4-Nitro-phenylalanine methyl ester

Packsize	Purity	Availability	Price	Discounted Price
1g	96%	in stock	$323.00	$226.00
5g	96%	in stock	$1,094.00	$766.00

Description

• Catalog Number: AC14528
• Chemical Name: 4-Nitro-phenylalanine methyl ester
• CAS Number: 85317-52-8
• Molecular Formula: C10H12N2O4
• Molecular Weight: 224.2133
• MDL Number: MFCD06410829
• SMILES: COC(=O)[C@H](Cc1ccc(cc1)[N+](=O)[O-])N

Computed Properties

• Complexity: 256
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 4
• Undefined Atom Stereocenter Count: 1
• XLogP3: 1.4

Literature

• (S)-1-Methoxy-carbonyl-3-(4-nitro-phen-yl)propan-2-aminium bromide.

  Acta crystallographica. Section E, Structure reports online 20091001