CAS
85896-01-1 Purity
96%
85896-01-1 Purity
96%
![Sodium(R)-alpha-[(3-ethoxy-1-methyl-3-oxo-1-propenyl)amino]cyclohexa-1,4-diene-1-acetate](https://resource.alfa-chemistry.com/structure/85896-05-5.gif)
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2-[[(1E)-2-(Methoxycarbonyl)-1-me-vinyl]amino]-(2R)-2-cyclohexa-1,4-dienylacetic acid
CAS
85896-06-6
Catalog Number
ACM85896066
Category
Other Products
Molecular Weight
273.26
Molecular Formula
C13H16NNaO4
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Specification
Synonyms
2-[[(1E)-2-(methoxycarbonyl)-1-me-vinyl]amino]-(2R)-2-cyclohexa-1,4-dienylacetic acid;(R)-(+)-alpha-[(3-Methoxy-1-methyl-3-oxo-1-propenyl)amino]-1,4-cyclohexadiene-1-acetic acid sodium salt
IUPAC Name
potassium;(2R)-2-cyclohexa-1,4-dien-1-yl-2-[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]acetate
Canonical SMILES
CC(=CC(=O)OC)NC(C1=CCC=CC1)C(=O)O
InChI Key
QXKDAXOBTDUKAB-VMEHJNRZSA-M
Melting Point
240ºC (dec.)(lit.)
Density
g/cm³
Appearance
White to off-white crystalline powder
Exact Mass
251.11600
H-Bond Acceptor
5
H-Bond Donor
1
Physical Description
2-[[(1E)-2-(Methoxycarbonyl)-1-Me-vinyl]amino]-(2R)-2-cyclohexa-1,4-dienylaceticacid Na salt, 98% (5g)
Safety Description
26-36
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