2-(4,5-dihydrofuran-3-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane - CAS 1046812-03-6
Catalog: |
BB001455 |
Product Name: |
2-(4,5-dihydrofuran-3-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
CAS: |
1046812-03-6 |
Synonyms: |
2-(2,3-dihydrofuran-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(2,3-dihydrofuran-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
IUPAC Name: | 2-(2,3-dihydrofuran-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
Description: | 2-(4,5-dihydrofuran-3-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (CAS# 1046812-03-6) is a useful reagent in iridium-catalyzed vinicylic C-H borylation. |
Molecular Weight: | 196.053 |
Molecular Formula: | C10H17BO3 |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=COCC2 |
InChI: | InChI=1S/C10H17BO3/c1-9(2)10(3,4)14-11(13-9)8-5-6-12-7-8/h7H,5-6H2,1-4H3 |
InChI Key: | NVQMFAGDOWSMOK-UHFFFAOYSA-N |
Storage: | Inert atmosphere, Store in freezer, under -20 °C |
LogP: | 1.92200 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021014172-A1 | Pyridine derivatives as calcium-activated chloride channel modulators | 20190724 |
AU-2018354777-A1 | Novel Pyrazolo-pyrrolo-pyrimidine-dione derivatives as P2X3 inhibitors | 20171027 |
WO-2019081343-A1 | NOVEL PYRAZOLO-PYRROLO-PYRIMIDINE-DIONE DERIVATIVES AS P2X3 INHIBITORS | 20171027 |
BR-112020008122-A2 | new pyrazolo-pyrrole-pyrimidine-dione derivatives as p2x3 inhibitors | 20171027 |
CN-111527090-A | Novel pyrazolo-pyrrolo-pyrimidine-dione derivatives as P2X3 inhibitors | 20171027 |
Complexity: | 255 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.1270746 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.1270746 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 27.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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