46022-05-3 | (1R,2R)-(-)-1,2-Cyclohexanedicarboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
10g	98%	in stock	$10.00	$7.00
25g	98%	in stock	$12.00	$9.00

Description

• Catalog Number: AI50698
• Chemical Name: (1R,2R)-(-)-1,2-Cyclohexanedicarboxylic acid
• CAS Number: 46022-05-3
• Molecular Formula: C8H12O4
• Molecular Weight: 172.1785
• MDL Number: MFCD00062973
• SMILES: C1CCC(C(C1)C(=O)O)C(=O)O

Computed Properties

• Complexity: 177
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 2
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 2
• XLogP3: 0.9

Literature

• Three-dimensional hydrogen-bonded structures in the guanidinium salts of the monocyclic dicarboxylic acids rac-trans-cyclohexane-1,2-dicarboxylic acid (2:1, anhydrous), isophthalic acid (1:1, monohydrate) and terephthalic acid (2:1, trihydrate).

  Acta crystallographica. Section C, Crystal structure communications 20101201

• Low-temperature redetermination of trans-cyclo-hexane-1,2-dicarboxylic acid.

  Acta crystallographica. Section E, Structure reports online 20080601

• Coexistence of spin frustration and long-range magnetic ordering in a triangular Co(II)3(mu3-OH)-based two-dimensional compound.

  Chemical communications (Cambridge, England) 20060114

• The 1:1 adduct of hexamethylenetetramine (HMT) with racemic trans-1,2-cyclohexanedicarboxylic acid (CDA).

  Acta crystallographica. Section C, Crystal structure communications 20040901