| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 9 | Yes |
Popular Name: 4-Bromo-3-fluorotoluene 4-Bromo-3-fluorotoluene
Find On: PubMed — Wikipedia — Google
CAS Numbers: 452-74-4 , [452-74-4]
1-Bromo-2-fluoro-4-methylbenzene
2-Fluoro-4-(methyl-d3)-bromobenzene
4-Bromo-3-fluoro-1-methylbenzene
4-Bromo-3-Fluorobenzenesulfonyl Chloride[351003-51-5]
4-Bromo-3-Fluorobenzotrifluoride [40161-54-4]; (2-Fluoro-4-(trifluoromethyl)bromobenzene)
4-Bromo-3-Fluorotoluene[452-74-4]
| 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) | 3.29 | 5.83 | -3.43 | 0 | 0 | 0 | 0 | 189.027 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 187-188? | Alfa-Aesar |
| Boiling_Point | 187-188° | Alfa-Aesar |
| BP | 191 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| BP [°C] | 95 (p=50 torr) | Acros Organics |
| BP | 95°/50mm | Matrix Scientific |
| Purity | 98% | Matrix Scientific |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation; H226: Flammable liquid and vapor | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water | Acros Organics |
| R phrase | R10: Flammable. | Acros Organics |
| R phrase | R10: Flammable.; R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S16: Keep away from sources of ignition - No smoking. | Acros Organics |
| S phrase | S16: Keep away from sources of ignition - No smoking.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection. | Acros Organics |
| Hazard | XI: Irritant | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.