| CAS Number | 149838-47-1 |
| Catalog Number | AG01A4FH(AGN-PC-0Q3VJ9) |
| Chemical Name | methyl 5-[(hydroxyimino)methyl]furan-3-carboxylate |
| IUPAC Name | methyl 5-(hydroxyiminomethyl)furan-3-carboxylate |
| InChI | InChI=1S/C7H7NO4/c1-11-7(9)5-2-6(3-8-10)12-4-5/h2-4,10H,1H3 |
| InChI Key | CGWRZJWTMUKLOX-UHFFFAOYSA-N |
| MDL Number | MFCD30328780 |
| Molecular Formula | C7H7NO4 |
| Molecular Weight | 169.1348 |
| SMILES | COC(C1C=C(C=NO)OC=1)=O |
| Synonyms | Methyl 5-[(hydroxyimino)methyl]furan-3-carboxylate,
149838-47-1,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.136g/mol |
| Monoisotopic Mass | 169.038g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 72A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number