253146
Methyl p-anisate
99%
Synonym(s):
p-Anisic acid methyl ester, Methyl 4-methoxybenzoate
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About This Item
Linear Formula:
CH3OC6H4CO2CH3
CAS Number:
Molecular Weight:
166.17
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
204-513-2
Beilstein/REAXYS Number:
2208571
MDL number:
Product Name
Methyl p-anisate, 99%
InChI key
DDIZAANNODHTRB-UHFFFAOYSA-N
InChI
1S/C9H10O3/c1-11-8-5-3-7(4-6-8)9(10)12-2/h3-6H,1-2H3
SMILES string
COC(=O)c1ccc(OC)cc1
assay
99%
form
solid
bp
244-245 °C (lit.)
mp
47-51 °C (lit.)
functional group
ester
Quality Level
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General description
Methyl p-anisate is a volatile compound released from Mycobacterium tuberculosis and is detected in the breath of tuberculosis patients. It is a potential biomarker for mycobacteria.
Storage Class
11 - Combustible Solids
wgk
WGK 2
flash_point_f
233.6 °F - closed cup
flash_point_c
112 °C - closed cup
ppe
Eyeshields, Gloves, type N95 (US)
Regulatory Information
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Amy Scott-Thomas et al.
Journal of breath research, 7(3), 037108-037108 (2013-07-23)
Mycobacterium tuberculosis releases four volatile compounds, methyl phenyl-acetate, methyl nicotinate, methyl p-anisate and o-phenylanisole, some of which we have previously been reported to be detected in the breath of tuberculosis patients (Syhre et al 2009 Tuberculosis 89 263-6). These volatiles have
Ronald P Manginell et al.
Journal of breath research, 7(3), 037107-037107 (2013-07-23)
Pathogenic Mycobacteria cause diseases in animals and humans with significant economic and societal consequences. Current methods for Mycobacterial detection relies upon time- and labor-intensive techniques such as culturing or DNA analysis. Using gas chromatography and mass spectrometry, four volatile compounds
Fabrizio Carta et al.
Bioorganic & medicinal chemistry letters, 21(8), 2521-2526 (2011-03-16)
The inhibition of the β-carbonic anhydrases (CAs, EC 4.2.1.1) from the pathogenic fungi Cryptococcus neoformans (Can2) and Candida albicans (Nce103) with a series of 25 branched aliphatic and aromatic carboxylates has been investigated. Human isoforms hCA I and II were
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