| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 9 | No |
Popular Name: 2-fluorobenzaldehyde 2-fluorobenzaldehyde
Find On: PubMed — Wikipedia — Google
CAS Numbers: 43114-43-8 , 446-52-6 , [446-52-6]
2-Fluoroacetophenone [445-27-2]
2-Fluorobenzaldehyde [446-52-6]
2-Fluorobenzhydrazide [446-24-2]
2-Fluorophenacyl Bromide ; (2-Bromo-2'-fluoroacetophenone)
| 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) | 1.84 | 4.29 | -10.16 | 0 | 1 | 0 | 17 | 124.114 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 44.5 | Acros Organics |
| MP | 44.5° | Fluorochem |
| MP | 45 | TCI |
| Melting_Point | 45? | Alfa-Aesar |
| Melting_Point | 45° | Alfa-Aesar |
| BP [°C] | 172 - 174 | Acros Organics |
| Boiling_Point | 172-174? | Alfa-Aesar |
| Boiling_Point | 172-174° | Alfa-Aesar |
| BP | 175 | TCI |
| BP | 90-91°/46mm | Fluorochem |
| Purity | 97% | Fluorochem |
| Purity | 98.5% | APIChem |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H335: May cause respiratory irritation; H315: Causes skin irritation; H302: Harmful if swallowed; H226: Flammable liquid and vapor | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye | Acros Organics |
| R phrase | R10: Flammable. | Acros Organics |
| R phrase | R10: Flammable.; R22: Harmful if swallowed.; 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 |
| PUBCHEM_PATENT_ID | US5622953 | IBM Patent Data |
| Hazard | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.