Structure

Quinoxaline-5-carboxylic acid

CAS
6924-66-9
Catalog Number
ACM6924669
Category
Other Products
Molecular Weight
174.1586
Molecular Formula
C9H6N2O2

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Specification

Synonyms
QUINOXALINE-5-CARBOXYLIC ACID;AKOS BBS-00005345;CHEMBRDG-BB 4402592;5-QUINOXALINECARBOXYLICACID;quinoxaline-5-carboxylic acid(SALTDATA: FREE);5-Carboxyquinoxaline;1,4-benzpyrazine-8-carboxylic acid;5-Carboxyquinoxaline, 5-Carboxy-1,4-benzodiazine
Hazard Statements
Xi
MDL Number
MFCD02854494
Size
1g,5g
What is the molecular formula of quinoxaline-5-carboxylic acid?

The molecular formula of quinoxaline-5-carboxylic acid is C9H6N2O2.

What is the molecular weight of quinoxaline-5-carboxylic acid?

The molecular weight of quinoxaline-5-carboxylic acid is 174.16 g/mol.

What is the IUPAC name of quinoxaline-5-carboxylic acid?

The IUPAC name of quinoxaline-5-carboxylic acid is quinoxaline-5-carboxylic acid.

What is the InChI of quinoxaline-5-carboxylic acid?

The InChI of quinoxaline-5-carboxylic acid is InChI=1S/C9H6N2O2/c12-9(13)6-2-1-3-7-8(6)11-5-4-10-7/h1-5H,(H,12,13).

What is the InChIKey of quinoxaline-5-carboxylic acid?

The InChIKey of quinoxaline-5-carboxylic acid is QLZNISOPACYKOR-UHFFFAOYSA-N.

How many hydrogen bond donor counts does quinoxaline-5-carboxylic acid have?

Quinoxaline-5-carboxylic acid has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does quinoxaline-5-carboxylic acid have?

Quinoxaline-5-carboxylic acid has 4 hydrogen bond acceptor counts.

What is the topological polar surface area of quinoxaline-5-carboxylic acid?

The topological polar surface area of quinoxaline-5-carboxylic acid is 63.1 〖A〗^2.

Is the compound canonicalized for quinoxaline-5-carboxylic acid?

Yes, the compound is canonicalized for quinoxaline-5-carboxylic acid.

When was quinoxaline-5-carboxylic acid last modified in PubChem?

Quinoxaline-5-carboxylic acid was last modified on December 30, 2023, in PubChem.

Upstream Synthesis Route 1

  • 131543-46-9
  • 603-81-6
  • 6924-66-9

Reference: [1] Organic Magnetic Resonance, 1980, vol. 14, # 4, p. 300 - 304

Upstream Synthesis Route 2

  • 131543-46-9
  • 603-81-6
  • 6924-66-9

Reference: [1]Organic Magnetic Resonance,1980,vol. 14,p. 300 - 304

Downstream Synthesis Route 1

  • 6924-66-9
  • 108-42-9
  • 928839-68-3

Reference: [1]Bioorganic and Medicinal Chemistry,2010,vol. 18,p. 2836 - 2848
[2]Patent: WO2007/28789,2007,A1 .Location in patent: Page/Page column 37

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

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