| CAS Number | 14757-79-0 |
| Catalog Number | AG00AQNP(AGN-PC-0A14TW) |
| Chemical Name | 2-Formylfuran-3-carboxylic acid |
| IUPAC Name | 2-formylfuran-3-carboxylic acid |
| InChI | InChI=1S/C6H4O4/c7-3-5-4(6(8)9)1-2-10-5/h1-3H,(H,8,9) |
| InChI Key | JOPTYRBQYCIAFR-UHFFFAOYSA-N |
| MDL Number | MFCD19228946 |
| Molecular Formula | C6H4O4 |
| Molecular Weight | 140.0936 |
| SMILES | OC(=O)C1=C(OC=C1)C=O |
| Synonyms | 2-Formylfuran-3-carboxylic acid,
14757-79-0,
SCHEMBL548142,
2,5-formylfurancarboxylic acid,
DTXSID30708027,
3-Furancarboxylic acid, 2-formyl-,
7337AA,
ZINC82410380,
AKOS006380548,
SC-48158,
AJ-125338,
C6H4O4,
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| 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
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Certificate of Analysis
Lot Number