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553735

Sigma-Aldrich

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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25 G
$153.00

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$153.00

About This Item

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

$153.00

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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

General description

1,1-Cyclohexanediacetic acid monoamide, also known as gabapentin amide, has neurological properties.[1] It is an important intermediate formed during the synthesis of a potential antiepileptic drug, gabapentin.[2]

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

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Certificates of Analysis (COA)

Lot/Batch Number
MKCW5990
MKCW1870
MKCS0037
MKCR2395
MKCS2262

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Development and Validation of 1, 1-Cyclohexanediacetic Acid Monoamide by using Spectrophotometry
Haque SM and Shanker P.
Residue Reviews, 5(2), 11-17 (2014)
High-efficiency aminocarbonylation by introducing CO to a pressurized continuous flow reactor.
Csajagi C, et al.
Organic Letters, 10(8), 1589-1589 (2008)

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