| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 10 | Yes |
Popular Name: 4-Methoxybenzyl alcohol 4-Methoxybenzyl alcohol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 105-13-5 , 4432-31-9 , [105-13-5]
"4-Methoxybenzyl alcohol, 98%"
4-methoxybenzyl alcohol; bmse010025; p-Methoxybenzyl alcohol
| 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) | 1.33 | 1.12 | -5.65 | 1 | 2 | 0 | 29 | 138.166 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| M.P | 22-25 °C | Indofine |
| Melting_Point | 22-25? | Alfa-Aesar |
| Melting_Point | 22-25° | Alfa-Aesar |
| Mp [°C] | 23 - 25.5 | Acros Organics |
| BP [°C] | 259 | Acros Organics |
| Boiling_Point | 259? | Alfa-Aesar |
| Boiling_Point | 259° | Alfa-Aesar |
| Purity | 99% | Fluorochem |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H318: Causes serious eye damage; H335: May cause respiratory irritation | Acros Organics |
| P phrase | P280: Wear eye protection/face protection | Acros Organics |
| P phrase | P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P310: Immediately call a POISON CENTER or doctor/physician; P26 | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R37/38: Irritating to respiratory system and skin.; R41: Risk of serious damage to eyes. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| S phrase | 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 | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.