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
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About This Item
Empirical Formula (Hill Notation):
C10H17NO3
CAS Number:
Molecular Weight:
199.25
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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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
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.
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
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Organic Letters, 10(8), 1589-1589 (2008)
Development and Validation of 1, 1-Cyclohexanediacetic Acid Monoamide by using Spectrophotometry
Haque SM and Shanker P.
Residue Reviews, 5(2), 11-17 (2014)
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