In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 10 | Yes |
Popular Name: 4-Ethylresorcinol 4-Ethylresorcinol
Find On: PubMed — Wikipedia — Google
CAS Number: 2896-60-8
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) | 2.29 | 0.28 | -5.06 | 2 | 2 | 0 | 40 | 138.166 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.81 | 4.12 | -43.71 | 0 | 2 | -1 | 40 | 137.158 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
BP | 155 / 10 | TCI |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
MP | 95 - 98 | Enamine Building Blocks |
Mp [°C] | 95 - 99 | Acros Organics |
Purity | 95% | Fluorochem |
MP | 95-98 °C(lit.) | Indofine |
Melting_Point | 95-98? | Alfa-Aesar |
MP | 95-98o C | Indofine |
Melting_Point | 95-98° | Alfa-Aesar |
MP | 95...98 | Enamine Building Blocks |
MP | 98 | TCI |
H phrase | H335: May cause respiratory irritation | Acros Organics |
H phrase | H335: May cause respiratory irritation; H315: Causes skin irritation; H319: Causes serious eye irritation | 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; 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 | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
SOLUBILITY | Soluble in Methanol | Indofine |
Hazard | XI: Irritant | Acros Organics |