ChemicalBook--->CAS DataBase List--->50650-75-4

50650-75-4

50650-75-4 Structure

50650-75-4 Structure
IdentificationBack Directory
[Name]

4-Methyl-6-(2,4,4-trimethylpentyl)-2H-pyran-2-one
[CAS]

50650-75-4
[Synonyms]

Piroctone Related CoMpound B
4-Methyl-6-(2,4,4-trimethylpentyl)-2-Pyrone
4-methyl-6-(2,4,4-trimethylpentyl)pyran-2-one
4-Methyl-6-(2,4,4-trimethylpentyl)-2H-pyran-2-one
2H-Pyran-2-one, 4-methyl-6-(2,4,4-trimethylpentyl)-
Piroctone Related Compound B (25 mg) (4-methyl-6-(2,4,4-trimethylpentyl)-2H-pyran-2-one)
Piroctone Related Compound B (4-methyl-6-(2,4,4-trimethylpentyl)-2H-pyran-2-one) (1544428)
[EINECS(EC#)]

610-555-6
[Molecular Formula]

C14H22O2
[MDL Number]

MFCD09263463
[MOL File]

50650-75-4.mol
[Molecular Weight]

222.32
Chemical PropertiesBack Directory
[Boiling point ]

326.4±11.0 °C(Predicted)
[density ]

0.951±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

Chloroform (Slightly), Ethyl Acetate (Slightly)
[form ]

Oil
[color ]

Colourless to Pale Yellow
[Major Application]

pharmaceutical
[InChI]

1S/C14H22O2/c1-10-6-12(16-13(15)8-10)7-11(2)9-14(3,4)5/h6,8,11H,7,9H2,1-5H3
[InChIKey]

LMCDKONPVQNISE-UHFFFAOYSA-N
[SMILES]

O1C(=CC(=CC1=O)C)CC(CC(C)(C)C)C
Safety DataBack Directory
[WGK Germany ]

WGK 3
[REACH Registrations]

Active
[HS Code ]

2932999000
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Uses]

4-Methyl-6-(2,4,4-trimethylpentyl)-2H-pyran-2-one is used in the synthesis of antibacterials and antimycotics. Related to Piroctone (P509400), an anti-dandruff agent used in shampoo formulations. Piroctone USP Related Compound B
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