4-Isoxazolepropanoic acid, α-amino-3-(carboxymethoxy)-5-methyl-, hydrate (2:3)
CAS Registry Number®
209977-56-0
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CAS Name
4-Isoxazolepropanoic acid, α-amino-3-(carboxymethoxy)-5-methyl-, hydrate (2:3)Molecular Formula
C9H12N2O6.3/2H2OCite this Page
4-Isoxazolepropanoic acid, α-amino-3-(carboxymethoxy)-5-methyl-, hydrate (2:3). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=209977-56-0 (retrieved ) (CAS RN: 209977-56-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C9H12N2O6.H2O/c1-4-5(2-6(10)9(14)15)8(11-17-4)16-3-7(12)13;/h6H,2-3,10H2,1H3,(H,12,13)(H,14,15);1H2
InChIKey
InChIKey=IVKRNODZJPBOGN-UHFFFAOYSA-N
SMILES
C(C(C(O)=O)N)C=1C(OCC(O)=O)=NOC1C.O
Canonical SMILES
O=C(O)COC1=NOC(=C1CC(N)C(=O)O)C.O
Other Names for this Substance
- 4-Isoxazolepropanoic acid, α-amino-3-(carboxymethoxy)-5-methyl-, hydrate (2:3)
