Diacetonamine acid oxalate monohydrate structure

Diacetonamine acid oxalate monohydrate

4-amino-4-methylpentan-2-one;oxalic acid;hydrate

Also Known As: Diacetonamine acid oxalate monohydrate|Diacetonamine hydrogen oxalate hydrate|EINECS 257-108-8|Diacetonamine acid oxalate monohydrate [MI]|7543AF|1,1-Dimethyl-3-oxobutylammonium hydrogen oxalate hydrate|DIACETONAMINEHYDROGENOXALATEHYDRATE|4-amino-4-methylpentan-2-one;oxalic acid;hydrate|4-amino-4-methylpentan-2-one oxalate hydrate|2-Pentanone, 4-amino-4-methyl-, oxalate (1:1), monohydrate|4-amino-4-methylpentan-2-one,oxalic acid,hydrate|2-Pentanone, 4-amino-4-methyl-, ethanedioate (1:1), monohydrate|2-Pentanone, 4-amino-4-methyl-, ethanedioate, hydrate (1:1:1)|4-amino-4-methylpentan-2-one; oxalic acid; hydrate|4-Amino-4-methyl-pentan-2-one; oxalic acid; hydrate|Oxalic acid--4-amino-4-methylpentan-2-one--water (1/1/1)

CAS: 5895-86-3
Molecular Formula C8H17NO6
Molecular Weight 223.10559 g/mol
LogP -0.9663
Topological Polar Surface Area 149.19 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 223.10559
Monoisotopic Mass 223.10559
Heavy Atoms 15
Complexity 217.77661

Chemical Identifiers

CAS Number 5895-86-3
SMILES CC(=O)CC(C)(C)N.C(=O)(C(=O)O)O.O

Product Overview

Diacetonamine acid oxalate monohydrate (CAS 5895-86-3), with molecular formula C8H17NO6 and molecular weight 223.10559 g/mol. IUPAC: 4-amino-4-methylpentan-2-one;oxalic acid;hydrate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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