553735

1,1-Cyclohexanediacetic acid monoamide

97%

• Synonym(s): 1-(2-Amino-2-oxoethyl)cyclohexaneacetic acid, 1-[(Aminocarbonyl)methyl]cyclohexaneacetic acid, 3,3-Pentamethyleneglutaramic acid
• Empirical Formula (Hill Notation): C₁₀H₁₇NO₃
• CAS Number: 99189-60-3
• Molecular Weight: 199.25
• MDL number: MFCD02181086
• UNSPSC Code: 12352100
• PubChem Substance ID: 24879349
• NACRES: NA.22

Properties

• Quality Level: 100
• Assay: 97%
• mp: 141-146 °C (lit.)
• functional group: amide; carboxylic acid
• SMILES string: NC(=O)CC1(CCCCC1)CC(O)=O
• InChI: 1S/C10H17NO3/c11-8(12)6-10(7-9(13)14)4-2-1-3-5-10/h1-7H2,(H2,11,12)(H,13,14)
• InChI key: QJGSJXLCJRXTRY-UHFFFAOYSA-N

Description

General description

1,1-Cyclohexanediacetic acid monoamide, also known as gabapentin amide, has neurological properties. It is an important intermediate formed during the synthesis of a potential antiepileptic drug, gabapentin.

Safety Information

• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves