| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 14 | No |
Popular Name: 2-Chloro-5-nitrobenzotrifluoride 2-Chloro-5-nitrobenzotrifluoride
Find On: PubMed — Wikipedia — Google
CAS Numbers: 777-37-7 , [777-37-7]
"2-Chloro-5-nitrobenzotrifluoride, 98%"
1-Chloro-4-nitro-2-(trifluoromethyl)benzene
2-Chloro-5-nitrobenzotrifluoride 98%
2-Chloro-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) | 3.40 | 3.66 | -5.15 | 0 | 3 | 0 | 45 | 225.553 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 102-103°/5mm | Matrix Scientific |
| Boiling_Point | 232? | Alfa-Aesar |
| Boiling_Point | 232° | Alfa-Aesar |
| Purity | 97% | Matrix Scientific |
| Melting_Point | ca 22? | Alfa-Aesar |
| Melting_Point | ca 22° | Alfa-Aesar |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.