| CAS Number | 1989672-52-7 |
| Catalog Number | AG01B6BT |
| Chemical Name | lithium(1+) ion 3-(5-methyl-1,3,4-oxadiazol-2-yl)propanoate |
| IUPAC Name | lithium;3-(5-methyl-1,3,4-oxadiazol-2-yl)propanoate |
| InChI | InChI=1S/C6H8N2O3.Li/c1-4-7-8-5(11-4)2-3-6(9)10;/h2-3H2,1H3,(H,9,10);/q;+1/p-1 |
| InChI Key | HNSJGFFYBQBPNA-UHFFFAOYSA-M |
| MDL Number | MFCD30342793 |
| Molecular Formula | C6H7LiN2O3 |
| Molecular Weight | 162.0724 |
| SMILES | [Li+].CC1OC(CCC([O-])=O)=NN=1 |
| Synonyms | 1989672-52-7,
Lithium 3-(5-methyl-1,3,4-oxadiazol-2-yl)propanoate,
lithium(1+) ion 3-(5-methyl-1,3,4-oxadiazol-2-yl)propanoate,
|
| Complexity | 156 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 162.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 162.073g/mol |
| Monoisotopic Mass | 162.062g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 79A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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