Formula of Kojic acid (C6H6O4)

Chemical Formula Description

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Additional Information for Identifying Kojic acid Molecule

• Structure Data File (SDF/MOL File) of kojic acid

  The structure data file (SDF/MOL File) of kojic acid is available for download in the SDF page of kojic acid providing the information about the atoms, bonds, connectivity and coordinates of kojic acid, which is not completely available in the chemical formula representation. The kojic acid structure data file can be imported to most of the cheminformatics software for further analysis and visualization.

• Chemical structure of kojic acid

  The chemical structure image of kojic acid is available in chemical structure page of kojic acid, which specifies the molecular geometry, i.e., the spatial arrangement of atoms in the chemical formula of kojic acid and the chemical bonds that hold the atoms together.

• Molecular weight of kojic acid

  The molecular weight of kojic acid is available in molecular weight page of kojic acid, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element specified in the chemical formula of kojic acid.

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• InChI (IUPAC International Chemical Identifier) information of kojic acid

  The molecular chemical formulas lack structural information. An alternative textual expression including the structural information is InChI. The full standard InChI of kojic acid is:

  InChI=1S/C6H6O4/c7-2-4-1-5(8)6(9)3-10-4/h1,3,7,9H,2H2

  It can provide a standard way to encode the molecular information of kojic acid to facilitate the search for the compound information in databases and on the web.
  
  

  The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of kojic acid is:

  InChIKey=BEJNERDRQOWKJM-UHFFFAOYSA-N

  The InChIKey may allow easier web searches for kojic acid, but it needs to be linked to the full InChI to get back to the original structure of the kojic acid since the full standard InChI cannot be reconstructed from the InChIKey.

• Other names (synonyms) or registry numbers of kojic acid

  The kojic acid compound may have different names depending on the various different situations of industrial applications. The list of the other names (synonyms) of kojic acid including the registry numbers is given below, if available:

  • T5832731
  • C-34530
  • EN300-20919
  • BBV-46884120
  • ZX-AFC000536
  • K-7000
  • 123712-78-7
  • Kojic acid pound>>5-hydroxy-2-(hydroxymethyl)-4h-pyran-4-on
  • Z381040328
  • F0001-1307

  • I14-19021
  • C65A72E0-0E46-4AF4-AA68-178ECA2E5FCC
  • 5-Hydroxy-2-(hydroxymethyl)-4H-pyran-4-one Solution
  • SR-01000945134-1
  • M-6079
  • K0012
  • K0010
  • 5-Hydroxy-2-(hydroxymethyl)-4H-pyran-4-
  • 2-Hydroxymethyl-5-hydroxy-4H-pyran-4-one
  • 2-HYDROXYMETHYL-5-HYDROXY-4-PYRONE

  • Kojic acid, purum, >=98.0% (HPLC)
  • H802
  • RTR-036891
  • 5-Hydroxy-2-(hydroxymethyl)-4-pyrond
  • 2-Hydroxymethyl-5-hydroxy-beta-pyrone
  • 2-Hydroxymethyl-5-Hydroxy-??-Pyrone
  • 5-hydroxy-2-hydroxymethylpyran-4-one
  • 2-Hydroxymethyl-5-hydroxy-|A-pyrone
  • CCG-38458
  • BDBM50031467

  • ANW-46611
  • 2-Hydroxymethyl-5-hydroxy-?-pyrone
  • KUC106760N
  • HMS3604L04
  • 6K23F1TT52
  • HMS502O05
  • Kojic acid, analytical standard
  • BIDD:ER0501
  • Kojic Acid Dipalmitate 5kg
  • Kojic acid, 99% 5g

  • Kojic Acid Solution
  • acido kojico
  • Kojicacid
  • Kojisaeure
  • CAS-501-30-4
  • Pyran-4-one, 5-hydroxy-2-(hydroxymethyl)
  • 5-Hydroxy-2-hydroxymethyl-pyran-4-one
  • MFCD00006580
  • 5-Hydroxy-2-hydroxymethyl-4H-pyran-4-one
  • 5-Hydroxy-2-hydroxymethyl-4H-4-pyranone

  • 2-(Hydroxymethyl)-5-hydroxy-4H-pyran-4-one
  • 2-Hydroxymethyl-5-hydroxy-gamma-pyrone
  • 5-hydroxy-2-(hydroxymethyl)pyran-4-one
  • 4H-PYRAN-4-ONE, 5-HYDROXY-2-(HYDROXYMETHYL)-
  • 5-Hydroxy-2-hydroxymethyl-4-pyrone
  • 5-Hydroxy-2-(hydroxymethyl)-4-pyrone
  • 501-30-4
  • kojic acid

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Kojic acid Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of kojic acid?
C6H6O4
How many atoms and what are they in the kojic acid structure?
16 atom(s) - 6 Hydrogen atom(s), 6 Carbon atom(s), and 4 Oxygen atom(s)
How many chemical bonds and what are they in the kojic acid structure?
16 bond(s) - 10 non-H bond(s), 3 multiple bond(s), 1 rotatable bond(s), 3 double bond(s), 1 six-membered ring(s), 1 ketone(s) (aliphatic), 2 hydroxyl group(s), 1 primary alcohol(s), and 1 ether(s) (aliphatic)
What’s the molecular weight of kojic acid?
142.10944 g/mol
What’s the SMILES string of kojic acid?
OCc1cc(=O)c(O)co1
What’s the InChI of kojic acid?
InChI=1S/C6H6O4/c7-2-4-1-5(8)6(9)3-10-4/h1,3,7,9H,2H2
What’s the InChIKey of kojic acid?
BEJNERDRQOWKJM-UHFFFAOYSA-N

2594 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).