3-(9H-carbazol-9-yl)phenylboronic acid

• CAS: 864377-33-3
• Catalog Number: ACM864377333
• Category: Boronic Acids
• Molecular Weight: 287.1g/mol
• Molecular Formula: C18H14BNO2
• IUPAC Name: (3-carbazol-9-ylphenyl)boronic acid
• Canonical SMILES: B(C1=CC(=CC=C1)N2C3=CC=CC=C3C4=CC=CC=C42)(O)O
• InChI: InChI=1S/C18H14BNO2/c21-19(22)13-6-5-7-14(12-13)20-17-10-3-1-8-15(17)16-9-2-4-11-18(16)20/h1-12,21-22H
• InChI Key: IDQUIFLAFFZYEX-UHFFFAOYSA-N
• Complexity: 369
• Covalently-Bonded Unit Count: 1
• Exact Mass: 287.111759g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 2
• Heavy Atom Count: 22
• Monoisotopic Mass: 287.111759g/mol
• Rotatable Bond Count: 2

Custom Q&A

What is the molecular formula of 3-(9H-carbazol-9-yl)phenylboronic acid?

The molecular formula is C18H14BNO2.

What is the molecular weight of 3-(9H-carbazol-9-yl)phenylboronic acid?

The molecular weight is 287.1 g/mol.

What is the IUPAC name of 3-(9H-carbazol-9-yl)phenylboronic acid?

The IUPAC name is (3-carbazol-9-ylphenyl)boronic acid.

What is the InChI key of 3-(9H-carbazol-9-yl)phenylboronic acid?

The InChI key is IDQUIFLAFFZYEX-UHFFFAOYSA-N.

What is the canonical SMILES of 3-(9H-carbazol-9-yl)phenylboronic acid?

The canonical SMILES is B(C1=CC(=CC=C1)N2C3=CC=CC=C3C4=CC=CC=C42)(O)O.

What is the CAS number of 3-(9H-carbazol-9-yl)phenylboronic acid?

The CAS number is 864377-33-3.

What is the European Community (EC) number of 3-(9H-carbazol-9-yl)phenylboronic acid?

The European Community (EC) number is 808-027-7.

What is the DSSTox Substance ID of 3-(9H-carbazol-9-yl)phenylboronic acid?

The DSSTox Substance ID is DTXSID10719252.

Is 3-(9H-carbazol-9-yl)phenylboronic acid a canonicalized compound?

Yes, it is canonicalized according to PubChem.

Synthetic Use

Upstream Synthesis Route 1

• 185112-61-2
• 121-43-7

• 864377-33-3

Reference: [1] Patent: CN103588770, 2016, B, . Location in patent: Paragraph 0047

Upstream Synthesis Route 2

• 185112-61-2

• 864377-33-3

Reference: [1] Patent: EP1820801, 2007, A1, . Location in patent: Page/Page column 84; 85

Upstream Synthesis Route 3

• 185112-61-2
• 150-46-9

• 864377-33-3

Reference: [1] Patent: KR2015/136713, 2015, A, . Location in patent: Paragraph 0094-0100

Downstream Synthesis Route 1

• 864377-33-3
• 1084334-27-9

• 1098257-62-5

Reference: [1]Patent: KR2019/64009,2019,A .Location in patent: Paragraph 0159-0161

Downstream Synthesis Route 2

• 864377-33-3
• 1197193-18-2

• 1262866-90-9

Reference: [1]Patent: WO2011/14039,2011,A1 .Location in patent: Page/Page column 22

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