| Pubchem Sid | 504761516 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504761516 |
| Canonical Smiles | B1(OC(C(O1)(C)C)(C)C)C2CC2 |
| IUPAC Name | 2-cyclopropyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChIKey | XGBMQBPLWXTEPM-UHFFFAOYSA-N |
| INCHI | 1S/C9H17BO2/c1-8(2)9(3,4)12-10(11-8)7-5-6-7/h7H,5-6H2,1-4H3 |
| Isomeric SMILES | B1(OC(C(O1)(C)C)(C)C)C2CC2 |
| WGK Germany | 3 |
| Molecular Weight | 168.04 |
| Reaxy-Rn | 10655619 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10655619&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic acids and derivatives |
| Class | Boronic acid derivatives |
| Subclass | Boronic acid esters |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Boronic acid esters |
| Alternative Parents | Dioxaborolanes Oxacyclic compounds Organic metalloid salts Organooxygen compounds Monoalkylboranes Hydrocarbon derivatives |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | 1,3,2-dioxaborolane - Boronic acid ester - Oxacycle - Organic metalloid salt - Organoheterocyclic compound - Organic oxygen compound - Monoalkylborane - Alkylborane - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organoboron compound - Aliphatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as boronic acid esters. These are compounds comprising the boronic acid ester functional group RN(X)OR' (R,R'=alkyl, aryl; X= any O, N, Hal residue). |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 J1817079 | Certificate of Analysis | May 20, 2026 | C120277 |
| A1317036 | Certificate of Analysis | Oct 12, 2024 | C120277 |
| F2302598 | Certificate of Analysis | May 08, 2023 | C120277 |
| F2302600 | Certificate of Analysis | May 08, 2023 | C120277 |
| F2302603 | Certificate of Analysis | May 08, 2023 | C120277 |
| F2302604 | Certificate of Analysis | May 08, 2023 | C120277 |
| F2302605 | Certificate of Analysis | May 08, 2023 | C120277 |
| H2528010 | Certificate of Analysis | May 08, 2023 | C120277 |
| Sensitivity | Moisture Sensitive |
|---|---|
| Refractive Index | 1.43 |
| Flash Point(°F) | 104 °F |
| Flash Point(°C) | 40°(104°F) |
| Boil Point(°C) | 146°C |
| Molecular Weight | 168.040 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 168.132 Da |
| Monoisotopic Mass | 168.132 Da |
| Topological Polar Surface Area | 18.500 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 181.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
