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53043-14-4

Basic Information
CAS No.: 53043-14-4
Name: o-n-amyl-m-cresol
Molecular Structure:
Molecular Structure of 53043-14-4 (o-n-amyl-m-cresol)
Formula: N/A
Molecular Weight: 178.274
Density: 0.9700
Melting Point: 24°C
Boiling Point: 260.36°C (estimate)
Flash Point: 240°F
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Chemistry

Molecular Formula: C12H18O
Molar mass: 178.27072 g/mol
Density: 0.955 g/cm3
Flash Point: 125.3 °C
Index of Refraction: 1.516
Boiling Point: 273.2 °C at 760 mmHg
Vapour Pressure: 0.00348 mmHg at 25°C
Category: toxic substances
Flammable hazardous characteristics: case of fire, or heat a more flammable; burning smoke to stimulate the
Fire-extinguishing agent: dry powder, foam, sand, carbon dioxide
Storage features: Treasury ventilated low-temperature drying; and stored separately from oxidizing agents
Structure of Amylmetacresol (53043-14-4):

XLogP3-AA: 4.4
H-Bond Donor: 1
H-Bond Acceptor: 1
Systematic Name: 5-Methyl-2-pentyl-phenol 
SMILES: Oc1cc(ccc1CCCCC)C 
InChI: InChI=1/C12H18O/c1-3-4-5-6-11-8-7-10(2)9-12(11)13/h7-9,13H,3-6H2,1-2H3
InChIKey: CKGWFZQGEQJZIL-UHFFFAOYAU 
Std. InChI: InChI=1S/C12H18O/c1-3-4-5-6-11-8-7-10(2)9-12(11)13/h7-9,13H,3-6H2,1-2H3 
Std. InChIKey: CKGWFZQGEQJZIL-UHFFFAOYSA-N

Uses

 Amylmetacresol (53043-14-4) is an antiseptic used to treat minor infections of the mouth and throat. It is one of two active ingredients in Gorpils lozenges or Strepsils. Boots Group or Gepach International also make a lozenge with this as active ingredient.

Toxicity Data With Reference

1.    

orl-rat LD50:1500 mg/kg

    PSEBAA    Proceedings of the Society for Experimental Biology and Medicine. 32 (1935),592.

Safety Profile

Moderately toxic by ingestion. Combustible liquid when exposed to heat or flame. Dangerous; when heated to decomposition it emits irritating fumes. Incompatible with oxidizing materials.

Specification

 Amylmetacresol (53043-14-4) also can be called 6-Amyl-m-cresol ; 5-Methyl-2-(pent-1-yl)phenol ; m-Cresol, 6-pentyl- ; 6-n-Pentyl-m-cresol ; 6-n-Amyl-m-cresol ;and ; 5-Methyl-2-pentylphenol .