In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2004 | 6 | Yes |
Popular Name: Methyl glycolate Methyl glycolate
1-methyl-4-(4-nitrophenyl)sulfonylsulfanyl-benzene
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) | -0.46 | -0.39 | -9.34 | 1 | 3 | 0 | 47 | 90.078 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Mp [°C] | 149 - 151 | Acros Organics |
BP | 149-151° | Oakwood Chemical |
Boiling_Point | 150-151? | Alfa-Aesar |
Boiling_Point | 150-151° | Alfa-Aesar |
BP | 151 | TCI |
BP [°C] | 52 (p=17 torr) | Acros Organics |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.