Bis(neopentyl glycolato)diboron

• CAS: 201733-56-4
• Catalog Number: ACM201733564
• Category: Other
• Molecular Weight: 225.9g/mol
• Molecular Formula: C10H20B2O4
• Synonyms: 5,5,5,5-TETRAMETHYL-2,2-BI-1,3,2-DIOXABORINANE;5,5,5,5-TETRAMETHYL-2,2-BIS(1,3,2-DIOXABORINANE);BIS(2,2-DIMETHYL-1,3-PROPANEDIOLATO)DIBORON;BIS(NEOPENTYL GLYCOLATO)DIBORON;BIS(NEOPENTYLGLYCOLATO)DIBORN;Bis(neopentylglycolato)diboron,min.97%;Bis(neopentylg
• IUPAC Name: 2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-5,5-dimethyl-1,3,2-dioxaborinane
• Canonical SMILES: B1(OCC(CO1)(C)C)B2OCC(CO2)(C)C
• InChI: InChI=1S/C10H20B2O4/c1-9(2)5-13-11(14-6-9)12-15-7-10(3,4)8-16-12/h5-8H2,1-4H3
• InChI Key: MDNDJMCSXOXBFZ-UHFFFAOYSA-N
• Complexity: 211
• Covalently-Bonded Unit Count: 1
• EC Number: 639-407-9
• Exact Mass: 226.154769g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• Heavy Atom Count: 16
• Monoisotopic Mass: 226.154769g/mol
• Rotatable Bond Count: 1

Custom Q&A

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

The molecular formula is C10H20B2O4.

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

The molecular weight is 225.9 g/mol.

What are the synonyms for Bis(neopentyl glycolato)diboron?

Some synonyms include 201733-56-4 and 5,5,5',5'-tetramethyl-2,2'-bi(1,3,2-dioxaborinane).

When was the compound Bis(neopentyl glycolato)diboron created and last modified?

It was created on 2005-07-19 and last modified on 2023-12-02.

What is the IUPAC name of Bis(neopentyl glycolato)diboron?

The IUPAC name is 2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-5,5-dimethyl-1,3,2-dioxaborinane.

What is the InChIKey for Bis(neopentyl glycolato)diboron?

The InChIKey is MDNDJMCSXOXBFZ-UHFFFAOYSA-N.

How many hydrogen bond acceptors are there in the compound?

There are 4 hydrogen bond acceptors.

What is the topological polar surface area of Bis(neopentyl glycolato)diboron?

The topological polar surface area is 36.9 Ų.

How many covalently-bonded units are there in the compound?

There is 1 covalently-bonded unit.

Is the compound Bis(neopentyl glycolato)diboron canonicalized?

Yes, the compound is canonicalized.

Synthetic Use

Downstream Synthesis Route 1

• 865-34-9
• 149817-62-9
• 201733-56-4

• 128143-86-2
• 1692-25-7
• 181866-50-2
• 381218-94-6

Reference: [1]Journal of the Chemical Society. Perkin Transactions 2 (2001),2002,p. 1669 - 1681

Downstream Synthesis Route 2

• 149817-62-9
• 201733-56-4

• 1148-79-4
• 128143-86-2
• 381218-94-6

Reference: [1]Journal of the Chemical Society. Perkin Transactions 2 (2001),2002,p. 1669 - 1681

Downstream Synthesis Route 3

• 865-34-9
• 149817-62-9
• 201733-56-4

• 128143-86-2
• 1692-25-7
• 181866-50-2
• 381218-94-6

Reference: [1] Journal of the Chemical Society. Perkin Transactions 2, 2002, # 10, p. 1669 - 1681

Downstream Synthesis Route 4

• 1122-91-4
• 201733-56-4

• 128376-65-8

Reference: [1] Tetrahedron Letters, 2012, vol. 53, # 46, p. 6230 - 6235,6

Downstream Synthesis Route 5

• 2042-37-7
• 201733-56-4

• 214360-47-1

Reference: [1] Tetrahedron Letters, 2005, vol. 46, # 10, p. 1671 - 1674

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