In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2004 | 8 | Yes |
Popular Name: 3,4,5-trimethyl-1H-pyrazole 3,4,5-trimethyl-1H-pyrazole
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 5519-42-6 , [5519-42-6]
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) | 1.14 | 2.7 | -5.7 | 1 | 2 | 0 | 29 | 110.16 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
BP | 130-134°/10 Torr | Matrix Scientific |
mp | 137 - 139 | MolMall (formerly Molecular Diversity Preservation International) |
MP | 138° | Matrix Scientific |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.