| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2007 | 11 | Yes |
Popular Name: 3-Bromo-5-(trifluoromethyl)pyridine 3-Bromo-5-(trifluoromethyl)pyridine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 436799-32-5 , 436799-33- , 436799-33-6 , 936841-70-2 , [436799-33-6]
3-Brom-5-(trifluormethyl)-pyridin
3-Bromo-4-(trifluoromethyl)pyridine
3-Bromo-5-(trifluoromethyl)pyridine 95%
3-Bromo-5-(trifluoromethyl)pyridine, 95%
3-Bromo-5-(trifluoromethyl)pyridine, 97%
3-Bromo-5-trifluoromethyl-pyridine
3-Bromo-5-trifluoromethylpyridine
| 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) | 2.55 | 4.29 | -2.24 | 0 | 1 | 0 | 13 | 225.995 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.55 | 4.59 | -36.12 | 1 | 1 | 1 | 14 | 227.003 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 35 - 36 | MolMall (formerly Molecular Diversity Preservation International) |
| MP | 35-36° | Matrix Scientific |
| MP | 43-45° | Oakwood Chemical |
| BP | 43°/14mm | Matrix Scientific |
| Melting_Point | 44-46? | Alfa-Aesar |
| Melting_Point | 44-46° | Alfa-Aesar |
| Mp [°C] | 45 - 46 | Acros Organics |
| BP | 62-63°/18mm | Fluorochem |
| BP [°C] | 65 - 66 (p=19 torr) | Acros Organics |
| bp | 65 - 66 (p=22 torr) | MolMall (formerly Molecular Diversity Preservation International) |
| Boiling_Point | 65-66?/19mm | Alfa-Aesar |
| Boiling_Point | 65-66°/19mm | Alfa-Aesar |
| Purity | 95% | Fluorochem |
| Purity | 97% | Matrix Scientific |
| Purity | 98% | Fluorochem |
| H phrase | H302: Harmful if swallowed | Acros Organics |
| H phrase | H302: Harmful if swallowed; H312: Harmful in contact with skin; H332: Harmful if inhaled | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P304 + P340: IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing; P305 + P35 | Acros Organics |
| R phrase | R20/21/22: Harmful by inhalation, in contact with skin and if swallowed. | Acros Organics |
| S phrase | S22: Do not breathe dust. | Acros Organics |
| Warnings | TOXIC | Matrix Scientific |
| Hazard | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.