| CAS Number | 26919-04-0 |
| Catalog Number | AG01C1PM(AGN-PC-00KAV5) |
| Chemical Name | 7-METHYL-5H,7H-FURO[3,4-B]PYRIDIN-5-ONE |
| IUPAC Name | 7-methyl-7H-furo[3,4-b]pyridin-5-one |
| InChI | InChI=1S/C8H7NO2/c1-5-7-6(8(10)11-5)3-2-4-9-7/h2-5H,1H3 |
| InChI Key | WCBNMIZQIWRCCE-UHFFFAOYSA-N |
| MDL Number | MFCD18260695 |
| Molecular Formula | C8H7NO2 |
| Molecular Weight | 149.1467 |
| SMILES | CC1C2=C(C=CC=N2)C(=O)O1 |
| Synonyms | 26919-04-0,
7-Methylfuro[3,4-b]pyridin-5(7H)-one,
7-methyl-5H,7H-furo[3,4-b]pyridin-5-one,
CTK0I5873,
DTXSID30514201,
AKOS030601282,
Furo[3,4-b]pyridin-5(7H)-one, 7-methyl-,
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| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 149.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 149.149g/mol |
| Monoisotopic Mass | 149.048g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Certificate of Analysis
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