CAS Number99769-19-4
SynonymsBenzoic acid, 3-borono-, methyl ester; 3-Methoxycarbonylphenylboronic acid; Methyl 3-boronobenzoate; (3-Methoxycarbonylphenyl)boronic acid; MFCD02093046; [3-(Methoxycarbonyl)phenyl]boronic acid; 3-(Methoxycarbonyl)phenylboronic acid; 3-(Methoxycarbonyl)benzeneboronic acid; QBQR CVO1
Molecular FormulaCH3O2CC6H4B(OH)2
Molecular Weight179.97
Purity98.00%
Density1.3±0.1 g/cm3
Boiling Point359.9±44.0 °C at 760 mmHg
Melting Point205-208 °C (lit.)
AppearanceWhite to light yellow crystal powder
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 99769-19-4 |
| Catalog No. | 2A-9049666 |
| Chinese Name | 3-甲氧基羰基苯硼酸 |
| Synonyms | Benzoic acid, 3-borono-, methyl ester; 3-Methoxycarbonylphenylboronic acid; Methyl 3-boronobenzoate; (3-Methoxycarbonylphenyl)boronic acid; MFCD02093046; [3-(Methoxycarbonyl)phenyl]boronic acid; 3-(Methoxycarbonyl)phenylboronic acid; 3-(Methoxycarbonyl)benzeneboronic acid; QBQR CVO1 |
| Molecular Formula | CH3O2CC6H4B(OH)2 |
| Molecular Weight | 179.97 |
| Purity | 98.00 |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 359.9±44.0 °C at 760 mmHg |
| Melting Point | 205-208 °C (lit.) |
| Appearance | White to light yellow crystal powder |
| Water Solubility | Water solubility: insoluble; soluble in: methanol |
| Storage Condition | Store airtight in a cool, dry warehouse. Keep away |
| Application | 3-(Methoxycarbonyl)phenylboronic acid is a biochemical reagent that can be used as a biological material or organic compound in life science-related research. |
| HTC | 2931900090 |
| PubChem ID | 24881314 |
| MDL Number | MFCD02093046 |
| SMILES | COC(=O)c1cccc(c1)B(O)O |
| InChI | 1S/C8H9BO4/c1-13-8(10)6-3-2-4-7(5-6)9(11)12/h2-5,11-12H,1H3 |
| InChI Key | ALTLCJHSJMGSLT-UHFFFAOYSA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352103 |
| MSDS | msds/49666_1_99769_19_4.pdf |
| Bioactivity | 3-(Methoxycarbonyl)phenylboronic acid is a biochemical reagent that can be used as a biological material or organic compound for life science related research. Related Catalog Research Areas >> Others In Vitro For tandem Pd(II)-catalyzed oxidation Heck reactions and intramolecular CH Reagents for the amidation sequence, copper-mediated ligand-free aerobic fluoroalkylation of arylboronic acids with fluoroalkyl iodides, one-pot homonitration of arylboronic acids, c Opper-catalyzed nitration, and ring condensation followed by palladium-phosphine-catalyzed Suzuki-Miyaura coupling. Reagents for the preparation of biaryl compounds via nickel-catalyzed cross-coupling reactions of Suzuki-Miyaura aryl halides with arylboronic acid 6, chromenone and its bradykinin B1 antagonist, Pt nanoparticles on photoactive metal-organic frameworks, and salicylate-based thienylbenzoic acid as an E. coli methionine aminopeptidase inhibitor via synergistic photoexcitation and electron injection. Chemical & Physical Properties Density 1.3±0.1 g/cm3 Boiling Point 359.9±44.0 °C at 760 mmHg Melting Point 205-208 °C(lit.) Molecular Formula C8H9BO4 Molecular Weight 179.97 Flash Point 171.5±28.4 °C Exact Mass 180.059387 PSA 66.76000 LogP 1.57 Vapor Pressure 0.0±0.8 mmHg at 25°C Index of Refraction 1.533 InChIKey ALTLCJHSJMGSLT-UHFFFAOYSA-N SMILES COC(=O)c1cccc(B(O)O)c1 Storage condition Refrigerator (+4°C) |
| Use of | 3-(Methoxycarbonyl)phenylboronic acid is a biochemical reagent that can be used as a biological material or organic compound for life science related research. related research. Related Catalog Research Areas >> Others In Vitro Reagents for tandem Pd(II)-catalyzed oxidative Heck reactions and intramolecular CH amidation sequences, copper-mediated ligand-free aerobic fluoroalkylation of arylboronic acids with fluoroalkyl iodides, one-pot homonitration of arylboronic acids, c Opper-catalyzed nitration, cyclic condensation followed by palladium-phosphine-catalyzed Suzuki-Miyaura coupling. Reagents for the preparation of biaryl compounds via nickel-catalyzed cross-coupling reactions of Suzuki-Miyaura aryl halides with arylboronic acid 6, chromenone and its bradykinin B1 antagonist, Pt nanoparticles on photoactive metal-organic frameworks, and salicylate-based thienylbenzoic acid as an E. coli methionine aminopeptidase inhibitor via synergistic photoexcitation and electron injection. Chemical & Physical Properties Molecular Formula C8H9BO4 Exact Mass 180.059387 PSA 66.76000 Index of Refraction 1.533 InChIKey ALTLCJHSJMGSLT-UHFFFAOYSA-N |
| Tax Rebate | 13.0% |
| Supervision | AB (Inbound cargo customs clearance form) |
| Transport Info | Product name: Purity: 97.0% |
| MSDS Transport Info | Module 14. Shipping information United Nations classification: inconsistent with United Nations classification standards UN number: not specified |
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