Products 110-13-4

CAS 110-13-4 appears in our catalog under these names: 2,5-Hexanedione, 2,5-Hexanedione, 97% , Acetonylacetone, >97.0%(GC), Acetonylacetone, 97%, 2,5-Hexanedione 98%. Offered by: TRC, Dr. Ehrenstorfer, Thermo Scientific (Alfa Aesar), TCI, Thermo Scientific (Acros). Available pack sizes: 100g, 500g, 1ml, 25g, 25ml, 100ml, 500ml, 1l.

Structural formula: {0} (CAS {1})

2,5-hexanedione is a diketone that is hexane substituted by oxo groups at positions 2 and 5. It is a toxic metabolite of hexane and of 2-hexanone. It has a role as a neurotoxin and a human xenobiotic metabolite. It is a diketone and a methyl ketone. It derives from a hydride of a hexane.

Source: ChEBI

Identity
Molecular formulaC6H10O2
Molecular weight114.14 g/mol
IUPAC namehexane-2,5-dione
InChIKeyOJVAMHKKJGICOG-UHFFFAOYSA-N
SMILESCC(=O)CCC(=O)C

Computed by PubChem (NCBI)