| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 5th, 2006 | 13 | Yes |
Popular Name: Ethyl 3-n-propylpyrazole-5-carboxylate Ethyl 3-n-propylpyrazole-5-carbo…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 133261-07-1 , 92945-27-2 , [92945-27-2]
1H-pyrazole-3-carboxylic acid, 5-propyl-, ethyl ester
3-Propyl-1H-pyrazole-5-carboxylic acid ethyl ester
5-n-Propyl-1H-pyrazole-3-carboxylic acid ethyl ester
Ethyl 3-propyl-1H-pyrazole-5-carboxylate
Ethyl 5-n-propyl-1H-pyrazole-3-carboxylate
Ethyl 5-n-propyl-1H-pyrazole-3-carboxylate, 98%
Ethyl 5-propyl-1H-pyrazole-3-carboxylate
Ethyl 5-propyl-2H-pyrazole-3-carboxylate
ethyl-3-propyl-1H-pyrazole-5-carboxylate
| 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) | 2.06 | 4.65 | -7.51 | 1 | 4 | 0 | 55 | 182.223 | 5 | ↓ |
| Ref Reference (pH 7) | 2.06 | 4.65 | -5 | 1 | 4 | 0 | 55 | 182.223 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 47-51? | Alfa-Aesar |
| Melting_Point | 47-51° | Alfa-Aesar |
| Purity | 98% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0463756A1; EP0463756B1; EP0526004A1; EP0526004B1; US5250534; US5272147; US5346901; US5426107; US5719283; US5977378; WO1999064033A1; WO1999064037A1 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.