TRANS-2-(4-CHLOROPHENYL)VINYLBORONIC ACID

• CAS: 154230-29-2
• Catalog Number: ACM154230292
• Category: Other Products
• Molecular Weight: 182.41g/mol
• Molecular Formula: C8H8BClO2
• IUPAC Name: [(E)-2-(4-chlorophenyl)ethenyl]boronic acid
• Canonical SMILES: B(C=CC1=CC=C(C=C1)Cl)(O)O
• InChI: InChI=1S/C8H8BClO2/c10-8-3-1-7(2-4-8)5-6-9(11)12/h1-6,11-12H/b6-5+
• InChI Key: HWSDRAPTZRYXHN-AATRIKPKSA-N
• Complexity: 153
• Covalently-Bonded Unit Count: 1
• Exact Mass: 182.030587g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 2
• Heavy Atom Count: 12
• Monoisotopic Mass: 182.030587g/mol
• Rotatable Bond Count: 2

Synthetic Use

Upstream Synthesis Route 1

• 873-73-4
• 274-07-7

• 154230-29-2

Reference: [1] Patent: WO2016/198836, 2016, A1, . Location in patent: Paragraph 00142

Upstream Synthesis Route 2

• 873-73-4

• 154230-29-2

Reference: [1] Australian Journal of Chemistry, 2011, vol. 64, # 1, p. 62 - 67

Upstream Synthesis Route 3

• 223919-54-8

• 154230-29-2

Reference: [1] Organic and Biomolecular Chemistry, 2015, vol. 13, # 26, p. 7136 - 7139