In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2008 | 11 | No |
Popular Name: 2-Fluoro-3-nitrotoluene 2-Fluoro-3-nitrotoluene
"2-Fluoro-3-nitrotoluene, 98%"
2-fluoro-1-methyl-3-nitrobenzene
2-Fluoro-3-methylnitrobenzene, 2-Fluoro-1-methyl-3-nitrobenzene
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) | 2.41 | 5.82 | -10.19 | 0 | 3 | 0 | 46 | 155.128 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
BP | 110-111° | Matrix Scientific |
BP | 111 / 12 | TCI |
Boiling_Point | 111?/12mm | Alfa-Aesar |
Melting_Point | 12/19/2013 12:00:00 AM | Alfa-Aesar |
Melting_Point | 12/19/2014 12:00:00 AM | Alfa-Aesar |
MP | 18-19° | Matrix Scientific |
MP | 19 | TCI |
MP | 19 - 21 | Enamine Building Blocks |
MP | 19...21 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 97% | Fluorochem |
Purity | 98% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
Warnings | Irritant/Store in Freezer | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.