| CAS Number | 1183430-59-2 |
| Catalog Number | AG019XGN(AGN-PC-0WO458) |
| Chemical Name | 2-(Furan-2-yl)thiazole-4-carbaldehyde |
| IUPAC Name | 2-(furan-2-yl)-1,3-thiazole-4-carbaldehyde |
| InChI | InChI=1S/C8H5NO2S/c10-4-6-5-12-8(9-6)7-2-1-3-11-7/h1-5H |
| InChI Key | CICRHHYRKYJFCY-UHFFFAOYSA-N |
| MDL Number | MFCD12776046 |
| Molecular Formula | C8H5NO2S |
| Molecular Weight | 179.1958 |
| SMILES | O=CC1N=C(C2OC=CC=2)SC=1 |
| Synonyms | 2-(furan-2-yl)-1,3-thiazole-4-carbaldehyde,
1183430-59-2,
2-(Furan-2-yl)thiazole-4-carbaldehyde,
AC1Q6PYL,
CTK7I0500,
ZINC37974105,
AKOS010225806,
MCULE-6100652252,
NE46687,
EN300-54934,
2-(2-furyl)thiazole-4-carbaldehyde,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.004g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.193g/mol |
| Monoisotopic Mass | 179.004g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 71.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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