| CAS Number | 105729-08-6 |
| Catalog Number | AG01B8US(AGN-PC-00NMMN) |
| Chemical Name | 1-(furan-2-yl)-2-methoxyethan-1-one |
| IUPAC Name | 1-(furan-2-yl)-2-methoxyethanone |
| InChI | InChI=1S/C7H8O3/c1-9-5-6(8)7-3-2-4-10-7/h2-4H,5H2,1H3 |
| InChI Key | SMOYZKAGAFPQAU-UHFFFAOYSA-N |
| MDL Number | MFCD12062662 |
| Molecular Formula | C7H8O3 |
| Molecular Weight | 140.1366 |
| SMILES | COCC(C1OC=CC=1)=O |
| Synonyms | 1-(furan-2-yl)-2-methoxyethan-1-one,
105729-08-6,
Ethanone, 1-(2-furanyl)-2-methoxy-,
SCHEMBL527184,
1-(2-furyl)-2-methoxyethanone,
1-(furan-2-yl)-2-methoxyethanone,
AKOS009991776,
I14-22232,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 140.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 140.138g/mol |
| Monoisotopic Mass | 140.047g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 39.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number