| CAS Number | 29182-07-8 |
| Catalog Number | AG01AD8R |
| Chemical Name | 3-Formylfuran-2-carboxylic acid |
| IUPAC Name | 3-formylfuran-2-carboxylic acid |
| InChI | InChI=1S/C6H4O4/c7-3-4-1-2-10-5(4)6(8)9/h1-3H,(H,8,9) |
| InChI Key | ICRNLRSCBXVFAL-UHFFFAOYSA-N |
| MDL Number | MFCD01859865 |
| Molecular Formula | C6H4O4 |
| Molecular Weight | 140.0936 |
| SMILES | OC(C1=C(C=O)C=CO1)=O |
| Synonyms | 3-formylfuran-2-carboxylic acid,
3-formyl-2-furoic acid,
29182-07-8,
AI-942/25034139,
2-Furancarboxylic acid, 3-formyl-,
formylfuran carboxylic acid,
formyl furan carboxylic acid,
SCHEMBL4641229,
CTK7I0154,
ICRNLRSCBXVFAL-UHFFFAOYSA-N,
FCH844943,
SBB086120,
ZINC20032360,
AKOS006275972,
FFCA,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 140.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 140.094g/mol |
| Monoisotopic Mass | 140.011g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number