Methyl 4-(1H-imidazol-1-yl)benzoate

Modify Date: 2025-08-25 15:40:56

Methyl 4-(1H-imidazol-1-yl)benzoate Structure
Methyl 4-(1H-imidazol-1-yl)benzoate structure
 Common Name Methyl 4-(1H-imidazol-1-yl)benzoate
CAS Number 101184-08-1 Molecular Weight 202.209
Density 1.2±0.1 g/cm3 Boiling Point 354.7±25.0 °C at 760 mmHg
Molecular Formula C11H10N2O2 Melting Point 124-127ºC(lit.)
MSDS Chinese USA Flash Point 168.3±23.2 °C
Symbol GHS07
GHS07		 Signal Word Warning

 Names

Name Methyl 4-(1H-imidazol-1-yl)benzoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 354.7±25.0 °C at 760 mmHg
Melting Point 124-127ºC(lit.)
Molecular Formula C11H10N2O2
Molecular Weight 202.209
Flash Point 168.3±23.2 °C
Exact Mass 202.074234
PSA 44.12000
LogP 1.96
Vapour Pressure 0.0±0.8 mmHg at 25°C
Index of Refraction 1.583
InChIKey KUBBZTZQWIGHFH-UHFFFAOYSA-N
SMILES COC(=O)c1ccc(-n2ccnc2)cc1

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xi: Irritant;
Risk Phrases 36/37/38
Safety Phrases 26-36
RIDADR NONH for all modes of transport
HS Code 2933290090

 Customs

HS Code 2933290090
Summary 2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Methyl 4-(1H-imidazol-1-yl)benzoateBioassay

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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
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
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
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
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
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.
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
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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
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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 Synonyms

Methyl 4-(1H-imidazol-1-yl)benzenecarboxylate
MFCD00127080
Benzoic acid, 4-(1H-imidazol-1-yl)-, methyl ester
methyl 4-imidazol-1-ylbenzoate
Methyl 4-(1H-imidazol-1-yl)benzoate
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