7-Bromoquinoxalin-2-ol

• CAS: 82031-32-1
• Catalog Number: ACM82031321
• Category: Bromine Series
• Molecular Weight: 225.04
• Molecular Formula: C8H5BrN2O
• Synonyms: 7-bromoquinoxalin-2(1H)-one;7-Bromo-1H-quinoxalin-2-one;7-Bromo-2(1H)-quinoxalinone;7-bromoquinoxalin-2-ol
• IUPAC Name: 7-bromo-1H-quinoxalin-2-one
• SMILES: C1=CC2=C(C=C1Br)NC(=O)C=N2
• InChI Key: PXVQWJPOMIRXQL-UHFFFAOYSA-N
• Density: 1.82 g/cm³
• Exact Mass: 223.95900
• H-Bond Acceptor: 2
• H-Bond Donor: 1

Custom Q&A

What is the PubChem CID of 7-Bromoquinoxalin-2-ol?

The PubChem CID of 7-Bromoquinoxalin-2-ol is 4913264.

What is the molecular formula of 7-Bromoquinoxalin-2-ol?

The molecular formula of 7-Bromoquinoxalin-2-ol is C8H5BrN2O.

What are the synonyms of 7-Bromoquinoxalin-2-ol?

The synonyms of 7-Bromoquinoxalin-2-ol are 7-bromoquinoxalin-2(1H)-one, 82031-32-1, 7-bromo-1H-quinoxalin-2-one, and 7-Bromo-2(1H)-quinoxalinone.

What is the molecular weight of 7-Bromoquinoxalin-2-ol?

The molecular weight of 7-Bromoquinoxalin-2-ol is 225.04 g/mol.

When was 7-Bromoquinoxalin-2-ol created?

7-Bromoquinoxalin-2-ol was created on September 17, 2005.

When was 7-Bromoquinoxalin-2-ol last modified?

7-Bromoquinoxalin-2-ol was last modified on December 3, 2023.

What is the IUPAC name of 7-Bromoquinoxalin-2-ol?

The IUPAC name of 7-Bromoquinoxalin-2-ol is 7-bromo-1H-quinoxalin-2-one.

What is the InChI of 7-Bromoquinoxalin-2-ol?

The InChI of 7-Bromoquinoxalin-2-ol is InChI=1S/C8H5BrN2O/c9-5-1-2-6-7(3-5)11-8(12)4-10-6/h1-4H,(H,11,12).

What is the InChIKey of 7-Bromoquinoxalin-2-ol?

The InChIKey of 7-Bromoquinoxalin-2-ol is PXVQWJPOMIRXQL-UHFFFAOYSA-N.

What is the Canonical SMILES of 7-Bromoquinoxalin-2-ol?

The Canonical SMILES of 7-Bromoquinoxalin-2-ol is C1=CC2=C(C=C1Br)NC(=O)C=N2.

Synthetic Use

Upstream Synthesis Route 1

• 1196-57-2

• 82031-32-1

Reference: [1]Patent: WO2013/40515,2013,A1 .Location in patent: Paragraph 0288

Downstream Synthesis Route 1

• 82031-32-1

• 89891-65-6

Reference: [1] Journal of Medicinal Chemistry, 2011, vol. 54, # 13, p. 4735 - 4751

Downstream Synthesis Route 2

• 82031-32-1

• 89891-65-6

Reference: [1] Patent: WO2007/38331, 2007, A2, . Location in patent: Page/Page column 34

Downstream Synthesis Route 3

• 82031-32-1

• 212327-11-2

Reference: [1] Journal of the American Chemical Society, 1949, vol. 71, p. 6,7

Downstream Synthesis Route 4

• 82031-32-1

• 89891-65-6

Reference: [1]Patent: WO2007/38331,2007,A2 .Location in patent: Page/Page column 34

Downstream Synthesis Route 5

• 82031-32-1

• 212327-11-2

Reference: [1]Journal of the American Chemical Society,1949,vol. 71,p. 6,7

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