| CAS Number | 4733-69-1 |
| Catalog Number | AG00DGVF(AGN-PC-0NI8PK) |
| Chemical Name | 5H,7H-furo[3,4-b]pyridin-7-one |
| IUPAC Name | 5H-furo[3,4-b]pyridin-7-one |
| InChI | InChI=1S/C7H5NO2/c9-7-6-5(4-10-7)2-1-3-8-6/h1-3H,4H2 |
| InChI Key | VIHJMAPRLIOYER-UHFFFAOYSA-N |
| MDL Number | MFCD01860224 |
| Molecular Formula | C7H5NO2 |
| Molecular Weight | 135.1201 |
| SMILES | O=C1C2=C(C=CC=N2)CO1 |
| Synonyms | FURO[3,4-B]PYRIDIN-7(5H)-ONE,
4733-69-1,
7-azaphthalide,
5H,7H-FURO[3,4-B]PYRIDIN-7-ONE,
SCHEMBL1728678,
5h-furo[3,4-b]pyridin-7-one,
DTXSID30482491,
VIHJMAPRLIOYER-UHFFFAOYSA-N,
furo[3,4-b]pyridine-7(5H)-one,
furo [3,4-b]pyridine-7(5H)-one,
ZINC25923854,
AB66596,
3-Hydroxymethyl picoline lacton,
furo[3,4-b]pyridin-5(7H)-one,
|
| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 135.032g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 135.122g/mol |
| Monoisotopic Mass | 135.032g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number