In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2005 | 17 | Yes |
Popular Name: 4-Benzyloxybenzoic acid 4-Benzyloxybenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1486-51-7 , [1486-51-7]
4-(benzyloxy)benzenecarboxylic acid
4-Benzyloxy Benzoic Acid [1486-51-7]
4-BENZYLOXYBENZOIC ACID; [1486-51-7]
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) | 3.50 | 0.98 | -49.96 | 0 | 3 | -1 | 49 | 227.239 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
BP [°C] | 125 (p=0.1 torr) | Acros Organics |
MP | 186-188° | Matrix Scientific |
Mp [°C] | 187 - 190 | Acros Organics |
Melting_Point | 187-191? | Alfa-Aesar |
Melting_Point | 187-191° | Alfa-Aesar |
MP | 188-191o C | Indofine |
MP | 189-192 °C(lit.) | Indofine |
MP | 190 | TCI |
Purity | 95% | Fluorochem |
Purity | 98% | Matrix Scientific |
H phrase | H302: Harmful if swallowed | Acros Organics |
H phrase | H302: Harmful if swallowed; H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation | 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; 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 | R22: Harmful if swallowed. | Acros Organics |
R phrase | R22: Harmful if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
Hazard | XN: Harmful | Acros Organics |