methyl 4-(2-methoxy-2-oxoethoxy)benzoate
methyl 4-(2-methoxy-2-oxoethoxy)benzoate structure
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Common Name | methyl 4-(2-methoxy-2-oxoethoxy)benzoate | ||
|---|---|---|---|---|
| CAS Number | 35005-30-2 | Molecular Weight | 224.21000 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C11H12O5 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | methyl 4-(2-methoxy-2-oxoethoxy)benzoate |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C11H12O5 |
|---|---|
| Molecular Weight | 224.21000 |
| Exact Mass | 224.06800 |
| PSA | 61.83000 |
| LogP | 1.02500 |
| InChIKey | KNKLWCHCJYAQKD-UHFFFAOYSA-N |
| SMILES | COC(=O)COc1ccc(C(=O)OC)cc1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~70%
methyl 4-(2-met... CAS#:35005-30-2 |
| Literature: BEZWADA BIOMEDICAL, LLC Patent: US2009/170927 A1, 2009 ; Location in patent: Page/Page column 14 ; |
|
~68%
methyl 4-(2-met... CAS#:35005-30-2 |
| Literature: Lyakhov; Lyakhova; Panchenko; Litvinova; Andronati Pharmaceutical Chemistry Journal, 2001 , vol. 35, # 12 p. 653 - 656 |
|
~7%
methyl 4-(2-met... CAS#:35005-30-2 |
| Literature: Banerjee, Amalendu; Adak, Mohini Mohan; Das, Sankar; Banerjee, Santa; Sengupta, Saumitra Journal of the Indian Chemical Society, 1987 , vol. 64, # 1 p. 34 - 37 |
|
~95%
methyl 4-(2-met... CAS#:35005-30-2 |
| Literature: Banerjee, Amalendu; Adak, Mohini Mohan; Das, Sankar; Banerjee, Santa; Sengupta, Saumitra Journal of the Indian Chemical Society, 1987 , vol. 64, # 1 p. 34 - 37 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 3 | |
![METHYL 3-OXO-3,4-DIHYDRO-2H-BENZO[B][1,4]OXAZINE-6-CARBOXYLATE structure](https://image.chemsrc.com/caspic/407/202195-67-3.png)
CAS#:202195-67-3
CAS#:83785-14-2This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| HMS2361C12 |
| methyl 4-carbomethoxyphenoxyacetate |
| 4-Methoxycarbonylmethoxy-benzoesaeure-methylester |
| 4-Carbomethoxy-phenoxyessigsaeure-methylester |
| 4-Methoxycarbonylmethoxy-benzoic acid methyl ester |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of methyl 4-(2-methoxy-2-oxoethoxy)benzoate? |
| A: SMILES notation of methyl 4-(2-methoxy-2-oxoethoxy)benzoate is COC(=O)COc1ccc(C(=O)OC)cc1. |
| Q: What is the molecular weight of methyl 4-(2-methoxy-2-oxoethoxy)benzoate? |
| A: Molecular weight of methyl 4-(2-methoxy-2-oxoethoxy)benzoate is 224.21000. |
| Q: What are the downstream products of methyl 4-(2-methoxy-2-oxoethoxy)benzoate? |
| A: Related downstream products(CAS) of methyl 4-(2-methoxy-2-oxoethoxy)benzoate: 19360-67-9;202195-67-3;83785-14-2. |
| Q: What are the upstream materials of methyl 4-(2-methoxy-2-oxoethoxy)benzoate? |
| A: Related upstream materials(CAS) of methyl 4-(2-methoxy-2-oxoethoxy)benzoate: 96-34-4;99-76-3;96-32-2;67-56-1;19360-67-9. |
| Q: What English synonyms does methyl 4-(2-methoxy-2-oxoethoxy)benzoate have? |
| A: English synonyms of methyl 4-(2-methoxy-2-oxoethoxy)benzoate: HMS2361C12, methyl 4-carbomethoxyphenoxyacetate, 4-Methoxycarbonylmethoxy-benzoesaeure-methylester, 4-Carbomethoxy-phenoxyessigsaeure-methylester, 4-Methoxycarbonylmethoxy-benzoic acid methyl ester. |
| Q: What is the InChIKey of methyl 4-(2-methoxy-2-oxoethoxy)benzoate? |
| A: InChIKey of methyl 4-(2-methoxy-2-oxoethoxy)benzoate is KNKLWCHCJYAQKD-UHFFFAOYSA-N. |
| Q: What is the English name of methyl 4-(2-methoxy-2-oxoethoxy)benzoate? |
| A: The English name of methyl 4-(2-methoxy-2-oxoethoxy)benzoate is methyl 4-(2-methoxy-2-oxoethoxy)benzoate. |
| Q: What is the CAS number of methyl 4-(2-methoxy-2-oxoethoxy)benzoate? |
| A: CAS number of methyl 4-(2-methoxy-2-oxoethoxy)benzoate is 35005-30-2. |
| Q: What is the Chinese name of 35005-30-2? |
| A: Chinese name of 35005-30-2 is 35005-30-2. |
| Q: What is the LogP of methyl 4-(2-methoxy-2-oxoethoxy)benzoate? |
| A: LogP of methyl 4-(2-methoxy-2-oxoethoxy)benzoate is 1.02500. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |