Bis(hexylene glycolato)diboron

• CAS: 230299-21-5
• Catalog Number: ACM230299215
• Category: Other
• Molecular Weight: 253.9g/mol
• Molecular Formula: C12H24B2O4
• Synonyms: 4,4,6-TRIMETHYL-2-(4,4,6-TRIMETHYL-1,3,2-DIOXABORINAN-2-YL)-1,3,2-DIOXABORINANE;4,4,4,4,6,6-HEXAMETHYL-2,2-BI-1,3,2-DIOXABORINANE;BIS(2-METHYL-2,4-PENTANEDIOLATO)DIBORON;BIS(1,3,3-TRIMETHYL-1,3-PROPANEDIOLATO)DIBORON;BIS(HEXYLENE GLYCOLATO)DIBORON;Bis(hex
• IUPAC Name: 4,4,6-trimethyl-2-(4,4,6-trimethyl-1,3,2-dioxaborinan-2-yl)-1,3,2-dioxaborinane
• Canonical SMILES: B1(OC(CC(O1)(C)C)C)B2OC(CC(O2)(C)C)C
• InChI: InChI=1S/C12H24B2O4/c1-9-7-11(3,4)17-13(15-9)14-16-10(2)8-12(5,6)18-14/h9-10H,7-8H2,1-6H3
• InChI Key: UEBSWKNVDRJVHN-UHFFFAOYSA-N
• Complexity: 279
• Covalently-Bonded Unit Count: 1
• Exact Mass: 254.18607g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• Heavy Atom Count: 18
• Monoisotopic Mass: 254.18607g/mol
• Rotatable Bond Count: 1

Custom Q&A

What is the molecular formula of Bis(hexylene glycolato)diboron?

The molecular formula is C12H24B2O4.

What is the molecular weight of Bis(hexylene glycolato)diboron?

The molecular weight is 253.9 g/mol.

What is the IUPAC Name of Bis(hexylene glycolato)diboron?

The IUPAC Name is 4,4,6-trimethyl-2-(4,4,6-trimethyl-1,3,2-dioxaborinan-2-yl)-1,3,2-dioxaborinane.

What is the InChI of Bis(hexylene glycolato)diboron?

The InChI is InChI=1S/C12H24B2O4/c1-9-7-11(3,4)17-13(15-9)14-16-10(2)8-12(5,6)18-14/h9-10H,7-8H2,1-6H3.

What is the InChIKey of Bis(hexylene glycolato)diboron?

The InChIKey is UEBSWKNVDRJVHN-UHFFFAOYSA-N.

What is the Canonical SMILES of Bis(hexylene glycolato)diboron?

The Canonical SMILES is B1(OC(CC(O1)(C)C)C)B2OC(CC(O2)(C)C)C.

What is the CAS number of Bis(hexylene glycolato)diboron?

The CAS number is 230299-21-5.

What is the European Community (EC) Number of Bis(hexylene glycolato)diboron?

The European Community (EC) Number is 673-658-5.

What is the DSSTox Substance ID of Bis(hexylene glycolato)diboron?

The DSSTox Substance ID is DTXSID00370396.

Is the compound canonicalized?

Yes, the compound is canonicalized.

Synthetic Use

Upstream Synthesis Route 1

• 107-41-5

• 230299-21-5

Reference: [1] Patent: WO2004/76467, 2004, A1, . Location in patent: Page 15

Upstream Synthesis Route 2

• 10199-14-1

• 230299-21-5

Reference: [1] Patent: CN105524099, 2016, A, . Location in patent: Paragraph 0016

Downstream Synthesis Route 1

• 695-12-5
• 230299-21-5

• 1325218-38-9

Reference: [1]Angewandte Chemie - International Edition,2011,vol. 50,p. 7158 - 7161

* For details of the synthesis route, please refer to the original source to ensure accuracy.