| CAS Number | 377729-87-8 |
| Catalog Number | AG01A4HZ |
| Chemical Name | 5-Fluorofuran-2-carboxylic acid |
| IUPAC Name | 5-fluorofuran-2-carboxylic acid |
| InChI | InChI=1S/C5H3FO3/c6-4-2-1-3(9-4)5(7)8/h1-2H,(H,7,8) |
| InChI Key | SYEGQVXXGOEAMS-UHFFFAOYSA-N |
| MDL Number | MFCD22421474 |
| Molecular Formula | C5H3FO3 |
| Molecular Weight | 130.0739 |
| SMILES | O=C(C1=CC=C(F)O1)O |
| Synonyms | 5-fluorofuran-2-carboxylic acid,
377729-87-8,
2-Furancarboxylic acid, 5-fluoro-,
5-fluoro-2-furoic acid,
SCHEMBL12611367,
SYEGQVXXGOEAMS-UHFFFAOYSA-N,
ZINC85395459,
AKOS023768845,
|
| Complexity | 125 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 130.007g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 130.074g/mol |
| Monoisotopic Mass | 130.007g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 50.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number