Basic Information

Drug ID DDPD11304 ...
Drug Name Phenoxyethanol
Molecular Weight 138.166
Molecular Formula C8H10O2
CAS Number 122-99-6
SMILES OCCOC1=CC=CC=C1
External Links
DRUGBANK DB11304
PubChem Compound 31236

Experimental Physicochemical Property

Property Name Property Value Unit Raw Value Raw Unit Reference
Boiling Point 245.0 ℃ 245 ℃ MSDS
Melting Point 13.0 ℃ 13 ℃ MSDS
Water Solubility 24000.0 mg/L 24 g/L MSDS

Pharmacokinetic/ Toxicokinetic Property

Property Name Property Value Unit Raw Value Raw Unit Annotation Reference
Metabolic 95.0 % >95 % Urinary excretion; DRUGBANK
Toxicity LD50 2250.0 mg/kg 2250.0 mg/kg skin/dermal; rabbit; DRUGBANK
Toxicity LC50 1980.0 mg/kg 1980.0 mg/kg PO, oral; Rattus, Rat; DRUGBANK
Eliminate Route 90.0 % >90 % Urinary excretion; Male, men; Rattus, Rat; DRUGBANK
Eliminate Route 90.0 % ~90 % Urinary excretion;  Female, women; Rattus, Rat; DRUGBANK
Eliminate Route 2.0 % ~2 % lung excretion;  Female, women; Rattus, Rat; DRUGBANK
Eliminate Route 1.3 % ~1.3 % lung excretion; Male, men; Rattus, Rat; DRUGBANK

Maximum Dosage

Not Available

Drug Property Radar Chart

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Note: Center: Q1-1.5*IQR, Edge: Q3+1.5*IQR; Q1: Quantile 1, Q3: Quantile 3, IQR: Q3-Q1