In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 13 | No |
Popular Name: 4-(2-oxiranylmethoxy)benzenecarbonitrile 4-(2-oxiranylmethoxy)benzenecarb…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 38791-92-3 , 70987-79-0 , [38791-92-3]
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) | 1.58 | 3.56 | -8.64 | 0 | 3 | 0 | 46 | 175.187 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 64 - 66 | Enamine Building Blocks |
melting_point | 64 - 67 | KeyOrganics |
MP | 64-67° | Matrix Scientific |
MP | 64...66 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |