Methyl anisate
Methyl anisate structure
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Common Name | Methyl anisate | ||
|---|---|---|---|---|
| CAS Number | 121-98-2 | Molecular Weight | 166.174 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 244 ºC | |
| Molecular Formula | C9H10O3 | Melting Point | 48-51 ºC | |
| MSDS | Chinese USA | Flash Point | 98.1±14.4 °C | |
Use of Methyl anisateMethyl anisate is an endogenous metabolite. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | methyl p-anisate |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | Methyl anisate is an endogenous metabolite. |
|---|---|
| Related Catalog |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| 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 |
| InChIKey | DDIZAANNODHTRB-UHFFFAOYSA-N |
| SMILES | COC(=O)c1ccc(OC)cc1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| 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 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 10 | |
CAS#:77-78-1
CAS#:99-96-7
CAS#:100-09-4
CAS#:616-38-6
CAS#:75-91-2
CAS#:123-11-5
CAS#:67-56-1
CAS#:7380-78-1
CAS#:104-92-7
CAS#:201230-82-2
CAS#:108779-09-5
CAS#:40757-20-8
CAS#:34841-06-0
CAS#:3290-99-1
CAS#:37908-98-8
CAS#:369-30-2
CAS#:329-45-3
CAS#:3672-47-7
CAS#:36755-02-9
CAS#:3462-97-3This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| 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% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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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... |
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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... |
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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... |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 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 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of methyl p-anisate? |
| A: Molecular weight of methyl p-anisate is 166.174. |
| Q: What are the downstream products of methyl p-anisate? |
| A: Related downstream products(CAS) of methyl p-anisate: 108779-09-5;40757-20-8;34841-06-0;3290-99-1;37908-98-8;369-30-2;329-45-3;3672-47-7;36755-02-9;3462-97-3. |
| Q: What are the upstream materials of methyl p-anisate? |
| A: Related upstream materials(CAS) of methyl p-anisate: 77-78-1;99-96-7;100-09-4;616-38-6;75-91-2;123-11-5;67-56-1;7380-78-1;104-92-7;201230-82-2. |
| Q: What is the boiling point of methyl p-anisate? |
| A: Boiling point of methyl p-anisate is 244 ºC. |
| Q: What is the CAS number of methyl p-anisate? |
| A: CAS number of methyl p-anisate is 121-98-2. |
| Q: What are the uses of methyl p-anisate? |
| A: Main uses of methyl p-anisate: Methyl anisate is an endogenous metabolite. |
| Q: What is the LogP of methyl p-anisate? |
| A: LogP of methyl p-anisate is 2.27. |
| Q: What is the polar surface area (PSA) of methyl p-anisate? |
| A: Polar surface area (PSA) of methyl p-anisate is 35.53000. |
| Q: What is the safety information for methyl p-anisate? |
| A: Safety information for methyl p-anisate: S22-S24/25. |
| Q: What is the English name of methyl p-anisate? |
| A: The English name of methyl p-anisate is methyl p-anisate. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |