| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 11 | Yes |
Popular Name: 4-Chloro-3-fluorobenzoic acid 4-Chloro-3-fluorobenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 403-17-8 , [403-17-8]
4-Chloro-3-fluorobenzoic acid 97%
4-Chloro-3-Fluorobenzoic Acid [403-17-8]
4-Chloro-3-fluorobenzoic acid, 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) | 2.62 | 1.36 | -42.48 | 0 | 2 | -1 | 40 | 173.55 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 159 - 161 | Enamine Building Blocks |
| MP | 159...161 | Enamine Building Blocks |
| MP | 190-192° | Oakwood Chemical |
| Melting_Point | 190-193? | Alfa-Aesar |
| MP | 190-193° | Matrix Scientific |
| Melting_Point | 190-196? | Alfa-Aesar |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Matrix Scientific |
| Purity | 98% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.