In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 13 | No |
Popular Name: 2-(Methylsulfonyl)-1-pyridin-4-ylethanone 2-(Methylsulfonyl)-1-pyridin-4-y…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 27302-94-9 , 27302-95-0
2-Methylsulfonyl-1-(pyridin-4-yl)ethanone
4-(2-Methylsulphonylacetyl)pyridine
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) | -0.43 | 1.07 | -22.7 | 0 | 4 | 0 | 64 | 199.231 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 115-117° | Matrix Scientific |
Purity | 95%+ | Fluorochem |
Warnings | Irritant | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.