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Diss Factsheets

Reference substances

Reference substances

Currently viewing:
IUPAC name:
potassium (4-hydroxyphenyl)[(3-methoxy-1-methyl-3-oxoprop-1-en-1-yl)amino]acetate

Inventory

EC number:
273-992-8
EC name:
Potassium (R)-(4-hydroxyphenyl)[(3-methoxy-1-methyl-3-oxoprop-1-enyl)amino]acetate
CAS number:
69416-61-1
CAS number:
69416-61-1
Synonyms
Names:
D(-)-p-Hydroxyphenylglycerine Dane Salt (K, Methyl)
D(-)-p-Hydroxyphenylglycine Dane Salt (K, Methyl)
Identifier:
IUPAC name
potassium;2-(4-hydroxyphenyl)-2-[(4-methoxy-4-oxobut-2-en-2-yl)amino]acetate
Identifier:
other: InChl
1S/C13H15NO5.K/c1-8(7-11(16)19-2)14-12(13(17)18)9-3-5-10(15)6-4-9;/h3-7,12,14-15H,1-2H3,(H,17,18);/q;+1/p-1
Identifier:
other: SMILES notation
CC(=CC(=O)OC)NC(C1=CC=C(C=C1)O)C(=O)[O-].[K+]

Molecular and structural information

Molecular formula:
C13H15NO5.K
Molecular weight:
303.352
SMILES notation:
[K+].Oc1ccc(cc1)[C@@H](NC(C)=CC(=O)OC)C([O-])=O
InChl:
InChI=1/C13H15NO5.K/c1-8(7-11(16)19-2)14-12(13(17)18)9-3-5-10(15)6-4-9;/h3-7,12,14-15H,1-2H3,(H,17,18);/q;+1/p-1
Structural formula:
Chemical structure

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