| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2004 | 15 | No |
Popular Name: 2,4-Dichloro-5-nitrobenzotrifluoride 2,4-Dichloro-5-nitrobenzotrifluo…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 400-70-4 , [400-70-4]
"2,4-Dichloro-5-Nitro benzotrifluoride, 98%"
1,5-dichloro-2-nitro-4-(trifluoromethyl)benzene
2,4-Dichloro-5-(trifluoromethyl)nitrobenzene, 1,5-Dichloro-2-nitro-4-(trifluoromethyl)benzene
2,4-Dichloro-5-Nitro benzotrifluoride
2,4-Dichloro-5-nitrobenzotrifluoride 98%
| 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) | 4.00 | 3.49 | -3.57 | 0 | 3 | 0 | 45 | 259.998 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 53 - 54 | MolMall (formerly Molecular Diversity Preservation International) |
| Melting_Point | 53-57? | Alfa-Aesar |
| Melting_Point | 53-57° | Alfa-Aesar |
| MP | 54 | TCI |
| MP | 54-55° | Oakwood Chemical |
| MP | 55 - 57 | Enamine Building Blocks |
| MP | 55-57° | Matrix Scientific |
| MP | 55...57 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Matrix Scientific |
| Warnings | IRRITANT, IRRITANT-HARMFUL | Matrix Scientific |
| Warnings | Irritant/Irritant-Harmful | Matrix Scientific |
| Purity | ¡Ý99% | APIChem |
No pre-computed analogs available. Try a structural similarity search.