| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 9 | Yes |
Popular Name: 5-Methyl-2-furoic acid 5-Methyl-2-furoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 1917-15-3 , [1917-15-3]
2-furancarboxylic acid, 5-methyl-
5-METHYL-2-FURANCARBOXYLIC ACID
5-Methyl-furan-2-carboxylic acid
5-methyl-furan-2-carboxylicacid
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.99 | 3.05 | -51.39 | 0 | 3 | -1 | 53 | 125.103 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 109 - 111 | Enamine Building Blocks |
| MP | 109...111 | Enamine Building Blocks |
| MP | 110° | Oakwood Chemical |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 99% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0768301A1; EP0824917A2; EP0824917A3; EP0994109A3; US5942536; US5962473; US5998630; US6126932; WO1997013512A1 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
