In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 16 | Yes |
Popular Name: phenyl salicylate phenyl salicylate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 118-55-8 , [118-55-8]
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) | 3.83 | 6.73 | -9.78 | 1 | 3 | 0 | 47 | 214.22 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.83 | 7.72 | -52.79 | 0 | 3 | -1 | 49 | 213.212 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
BP [°C] | 172 - 173 (p=12 torr) | Acros Organics |
Boiling_Point | 172-174?/12mm | Alfa-Aesar |
Boiling_Point | 172-174°/12mm | Alfa-Aesar |
BP | 173 / 12 | TCI |
Mp [°C] | 40 - 44 | Acros Organics |
Melting_Point | 41-45? | Alfa-Aesar |
Melting_Point | 41-45° | Alfa-Aesar |
MP | 44 | TCI |
MP | 44 - 46 | Enamine Building Blocks |
MP | 44...46 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 99% | APIChem |
H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation | Acros Organics |
P phrase | P280: Wear protective gloves/protective clothing/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 | Acros Organics |
R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
Hazard | XI: Irritant | Acros Organics |