CAS
91197-50-1 Purity
96%
91197-50-1 Purity
96%
![Benzoic acid,2-[(2-hydroxybenzoyl)amino]-,(1ar,1bs,4r,4as,7as,7bs,8r,9r,9as)-9a-(acetyloxy)-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-4,4a,7b-trihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1H-cyclop](https://resource.alfa-chemistry.com/structure/91197-54-5.gif)
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2-(Carboxymethyl)-2,4-dihydroxy-4-oxobutanoate;diethyl-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]azanium
CAS
912-02-7
Catalog Number
ACM912027
Category
Other Products
Molecular Weight
436.456 g/mol
Molecular Formula
C21H28N2O8
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Specification
Synonyms
ISOXAZOLE,3-(2-(DIETHYLAMINO)ETHYL)-5-PHENYL-,CITRATE (1:1); diethyl-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]azanium; 3-(2-(Diethylamino)ethyl)-5-phenylisoxazole citrate;
IUPAC Name
2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate; diethyl-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]azanium
Canonical SMILES
CC[NH+](CC)CCC1=NOC(=C1)C2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O
InChI Key
MBRCQFGYINKZOH-UHFFFAOYSA-N
Boiling Point
373.4ºC at 760 mmHg
Flash Point
179.6ºC
Exact Mass
436.18500
H-Bond Acceptor
9
H-Bond Donor
4
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