2,4-Dimethoxyprimidine-5-boronic acid

• CAS: 89641-18-9
• Catalog Number: ACM89641189
• Category: Other Products
• Molecular Weight: 183.96g/mol
• Molecular Formula: C6H9BN2O4
• Synonyms: RARECHEM AH PB 0101;AKOS BRN-0112;2,4-Dimethoxyprimidine-5-boronic acid; ;2,4-Dimethoxy-pyrimidine-5-boric acid;2,4-Dimethoxy-5-Pyrimidine boronic acid;2,4-DIMETHOXYPRYIMIDINE-5-BORONIC ACID;2,4-Dimethoxypyrimidine-5-Boro;(2,4-DIMETHOXYPYRIMIDIN-5-YL)BORON
• IUPAC Name: (2,4-dimethoxypyrimidin-5-yl)boronic acid
• Canonical SMILES: B(C1=CN=C(N=C1OC)OC)(O)O
• InChI: InChI=1S/C6H9BN2O4/c1-12-5-4(7(10)11)3-8-6(9-5)13-2/h3,10-11H,1-2H3
• InChI Key: LKGKUACPLXCVOF-UHFFFAOYSA-N
• Complexity: 160
• Covalently-Bonded Unit Count: 1
• Exact Mass: 184.065537g/mol
• Formal Charge: 0
• H-Bond Acceptor: 6
• H-Bond Donor: 2
• Heavy Atom Count: 13
• Monoisotopic Mass: 184.065537g/mol
• Rotatable Bond Count: 3

Synthetic Use

Upstream Synthesis Route 1

• 56686-16-9

• 89641-18-9

Reference: [1] Journal of Materials Chemistry C, 2017, vol. 5, # 37, p. 9638 - 9650

Upstream Synthesis Route 2

• 7647-01-0

• 89641-18-9

Reference: [1] Journal of Materials Chemistry C, 2017, vol. 5, # 37, p. 9638 - 9650

Downstream Synthesis Route 1

• 298-12-4
• 89641-18-9

• 52606-02-7

Reference: [1] Angewandte Chemie - International Edition, 2017, vol. 56, # 28, p. 8201 - 8205[2] Angew. Chem., 2017, vol. 129, # 28, p. 8313 - 8317,5

Downstream Synthesis Route 2

• 724466-73-3
• 89641-18-9

• 1025840-19-0

Reference: [1]Journal of Medicinal Chemistry,2007,vol. 50,p. 984 - 1000

Downstream Synthesis Route 3

• 5315-25-3
• 89641-18-9

• 952402-48-1

Reference: [1]Patent: WO2007/113232,2007,A1 .Location in patent: Page/Page column 87-88

Downstream Synthesis Route 4

• 3430-13-5
• 89641-18-9

• 952402-56-1

Reference: [1]Patent: WO2007/113232,2007,A1 .Location in patent: Page/Page column 91

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