Amylmetacresol

Category	Human immunodeficiency Virus (HIV)
CAS	1300-94-3
Description	Amylmetacresol (AMC) is an antiseptic available in Canada over-the-counter in a number of lozenges for the treatment of sore throat and minor mouth infections. Amylmetacresol is often combined with dichlorobenzyl alcohol and menthol in the commonly used sore throat lozenges, known as Strepsils.

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Synonyms	Amylmetacresol\|5-Methyl-2-pentylphenol\|1300-94-3\|5-methyl-2-n-pentylphenol\|6-Pentyl-m-cresol\|6-Amyl-m-cresol\|6-n-Amyl-m-cresol\|6-n-Pentyl-m-cresol\|amylmetacresolum\|Phenol, 5-methyl-2-pentyl-\|UNII-05W904P57F\|2-Amyl-5-methylphenol\|CHEBI:48213\|05W904P57F\|NCGC00180998-01\|Amilmetacresol\|Amilmetacresol [Spanish]\|Amylmetacresolum [Latin]\|Amylmetacresol [INN:BAN]\|BRN 2440952\|m-Cresol, 6-pentyl-\|EINECS 215-094-0\|Amyl metacresol\|DSSTox_CID_26791\|DSSTox_RID_81908\|DSSTox_GSID_46791\|3-06-00-02005 (Beilstein Handbook Reference)\|SCHEMBL302197\|CHEMBL1512677\|DTXSID8046791\|BAA30094\|ZINC2039651\|Tox21_112651\|MFCD00127710\|s6173\|STL453583\|AKOS015912095\|DB13908\|5-methyl-2-N-pentylphenol, AldrichCPR\|DS-15450\|CAS-1300-94-3\|HY-121527\|CS-0082471\|FT-0620948\|Amylmetacresol 100 microg/mL in Acetonitrile\|A888790\|SR-01000944860\|Q1946346\|SR-01000944860-1\|W-108357
Molecular Weight	178.27
Molecular Formula	C12H18O
Canonical SMILES	CC1=CC(O)=C(CCCCC)C=C1
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
InChIKey	CKGWFZQGEQJZIL-UHFFFAOYSA-N
Boiling Point	273.2°C at 760 mmHg
Melting Point	67.82 °C (Predicted)
Flash Point	125.3°C
Purity	≥98%
Density	0.955g/cm3
Solubility	Soluble in DMSO.
Appearance	Solid Powder
Storage	Powder: -20°C: 3 years 4°C: 2 years In solvent: -80°C: 6 months -20°C: 1 month
Complexity	133
Exact Mass	178.13600
Index Of Refraction	1.516
PSA	20.23000
Target	HIV
Vapor Pressure	0.00348mmHg at 25°C
XLogP3-AA	4.4