1,1-Dimethyl-3-oxobutylammonium hydrogen oxalate hydrate
[CAS# 51283-38-6]

Identification

• Name: 1,1-Dimethyl-3-oxobutylammonium hydrogen oxalate hydrate
• Synonyms: 4-Amino-4-Methyl-Pentan-2-One; Oxalic Acid; Hydrate; 4-Amino-4-Methyl-Pentan-2-One; Ethanedioic Acid; Hydrate
• Molecular Formula: C₈H₁₇NO₆
• Molecular Weight: 223.23
• CAS Registry Number: 51283-38-6
• EINECS: 257-108-8
• SMILES: O=C(C(=O)O)O.C(C(N)(C)C)C(=O)C.O
• InChI: 1S/C6H13NO.C2H2O4.H2O/c1-5(8)4-6(2,3)7;3-1(4)2(5)6;/h4,7H2,1-3H3;(H,3,4)(H,5,6);1H2
• InChIKey: WTWLHIRBZWLOBP-UHFFFAOYSA-N

Properties

• Boiling point: 169.4°C at 760 mmHg (Cal.)
• Flash point: 56.2°C (Cal.)