| CAS Number | 21300-07-2 |
| Catalog Number | AG00BHGF(AGN-PC-0JK7I4) |
| Chemical Name | 5-Methoxyfuran-2-carbaldehyde |
| IUPAC Name | 5-methoxyfuran-2-carbaldehyde |
| InChI | InChI=1S/C6H6O3/c1-8-6-3-2-5(4-7)9-6/h2-4H,1H3 |
| InChI Key | RJGBSYZFOCAGQY-UHFFFAOYSA-N |
| MDL Number | MFCD21800637 |
| Molecular Formula | C6H6O3 |
| Molecular Weight | 126.1100 |
| SMILES | COC1OC(C=O)=CC=1 |
| Synonyms | 5-Methoxyfuraldehyde,
5-methoxyfuran-2-carbaldehyde,
5-methoxyfurfural,
21300-07-2,
2-Furancarboxaldehyde, 5-methoxy-,
AC1Q6QB2,
SCHEMBL54493,
5-methoxy-furan-2-carbaldehyde,
AC1L1M10,
CTK4E6383,
DTXSID00274481,
RJGBSYZFOCAGQY-UHFFFAOYSA-N,
ZINC2041308,
AKOS017669778,
CID6208,
AR-1G8721,
2181-47-7,
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| Complexity | 103 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 126.032g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 126.111g/mol |
| Monoisotopic Mass | 126.032g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 39.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number