Methyl anisate

Names

[ CAS No. ]:
121-98-2

[ Name ]:
Methyl anisate

[Synonym ]:
Methylanisate
Benzoic acid, 4-methoxy-, methyl ester
p-Anisic acid methyl ester
METHYL-4-METHOXY BENZOATE
4-METHOXYBENZOIC ACID METHYL ESTER
Methyl p-Anisate
Methyl 4-methoxybenzoate
METHYL P-METHOXYBENZOATE
METHYL-4-METHOXYBENZOATE
METHYL 4-METHOXYBENZOATE (METHYL P-ANISATE)
Methyl Anisate
EINECS 204-513-2
METHYL 4-METHOXYBENZOATE/4-METHOXYBENZOIC ACID METHYL ESTER/METHYL P-ANISATE
MFCD00008437
METHYL-P-METHOXY BENZOATE
METHYL-P-ANISATE
METHYL P-ANISATE (METHYL P-METHOXYBENZOATE)
p-Anisic acid methyl ester,Methyl 4-methoxybenzoate
4-METHOXYL BENZOIC ACID METHYL ESTER
ANISIC ACID METHYL ESTER
BENZOIC ACID,4-METHOXY-, METHYL ESTER
METHYL4-METHOXYBENZOATE

Biological Activity

[Description]:

Methyl anisate is an endogenous metabolite.

[Related Catalog]:

Research Areas >> Metabolic Disease

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
244 ºC

[ Melting Point ]:
48-51 ºC

[ Molecular Formula ]:
C₉H₁₀O₃

[ Molecular Weight ]:
166.174

[ Flash Point ]:
98.1±14.4 °C

[ Exact Mass ]:
166.062988

[ PSA ]:
35.53000

[ LogP ]:
2.27

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.503

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: BZ4925000

CHEMICAL NAME :: p-Anisic acid, methyl ester

CAS REGISTRY NUMBER :: 121-98-2

BEILSTEIN REFERENCE NO. :: 2208571

LAST UPDATED :: 199701

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C9-H10-O3

MOLECULAR WEIGHT :: 166.19

WISWESSER LINE NOTATION :: 1OVR DO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

REFERENCE :: FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,481,1976 ** ACUTE TOXICITY DATA **

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >5 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,481,1976

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: >5 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,481,1976

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter

[ Hazard Codes ]:
Xi: Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S22-S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
BZ4925000

[ Packaging Group ]:
III

[ HS Code ]:
2918990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 2918990090

[ Summary ]:
2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Articles

Carbonic anhydrase inhibitors. Inhibition of the β-class enzymes from the fungal pathogens Candida albicans and Cryptococcus neoformans with branched aliphatic/aromatic carboxylates and their derivatives.

Bioorg. Med. Chem. Lett. 21 , 2521-6, (2011)

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...

Validating a breath collection and analysis system for the new tuberculosis breath test.

J. Breath Res. 7(3) , 037108, (2013)

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 detect...

Diagnostic potential of the pulsed discharged helium ionization detector (PDHID) for pathogenic Mycobacterial volatile biomarkers.

J. Breath Res. 7(3) , 037107, (2013)

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 tech...

Related Compounds

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