10421-85-9 | 2-Chloromandelic acid

Packsize	Purity	Availability	Price	Discounted Price
5g	97%	in stock	$9.00	$6.00
25g	97%	in stock	$12.00	$8.00
100g	97%	in stock	$38.00	$26.00

Description

• Catalog Number: AB61893
• Chemical Name: 2-Chloromandelic acid
• CAS Number: 10421-85-9
• Molecular Formula: C8H7ClO3
• Molecular Weight: 186.5924
• MDL Number: MFCD00084962
• SMILES: OC(=O)C(c1ccccc1Cl)O
• NSC Number: 31401

Computed Properties

• Complexity: 172
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 2
• Undefined Atom Stereocenter Count: 1
• XLogP3: 1.5

Literature

• Efficient production of (R)-o-chloromandelic acid by deracemization of o-chloromandelonitrile with a new nitrilase mined from Labrenzia aggregata.

  Applied microbiology and biotechnology 20120701

• Resolution of 2-chloromandelic acid with (R)-(+)-N-benzyl-1-phenylethylamine: chiral discrimination mechanism.

  Chirality 20120501

• The isolation of a metastable conglomerate using a combined computational and controlled crystallization approach.

  Chemical communications (Cambridge, England) 20120214

• Identification and characterization of solid-state nature of 2-chloromandelic acid.

  Journal of pharmaceutical sciences 20090501

• Preparation of (R)-(-)-mandelic acid and its derivatives from racemates by enantioselective degradation with a newly isolated bacterial strain Alcaligenes sp. ECU0401.

  Bioprocess and biosystems engineering 20080801