3-Methyl-2-furoic acid
ALDRICH/667994 - 97%
Synonym: 3-
CAS Number: 4412-96-8
Empirical Formula (Hill Notation): C6H6O3
Molecular Weight: 126.11
EC Number: 224-571-2
MDL Number: MFCD00014111
Linear Formula: C6H6O3
Product Type: Chemical
| assay | 97% |
| form | solid |
| functional group | carboxylic acid |
| InChI | 1S/C6H6O3/c1-4-2-3-9-5(4) |
| InChI key | BNYIQEFWGSXIKQ-UHFFFAOYSA |
| mp | 134-138 °C |
| Quality Level | 100 ![]() |
| SMILES string | Cc1ccoc1C(O)=O |
| Application: | Used in a palladium-catalyzed cross-coupling between heteroaryl carboxylic acids and aryl bromides leading to arylated heterocycles. Also used in a palladium-catalyzed asymmetric hydrogenation. |
| Packaging: | 1, 5 g in glass bottle |
| Symbol | GHS07 |
| Signal word | Warning |
| Hazard statements | H315 - H319 - H335 |
| Precautionary statements | P302 + P352 - P305 + P351 + P338 |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | WGK 3 |
| Flash Point(F) | Not applicable |
| Flash Point(C) | Not applicable |
| Purity | 97% |
| mp | 134-138 °C |
| UNSPSC | 12352100 |


