2,2,7-Trimethyl-2,6,7,8-tetrahydro-chromen-5-one

Base Information

• Chemical Name: 2,2,7-Trimethyl-2,6,7,8-tetrahydro-chromen-5-one
• CAS No.: 504439-23-0
• Molecular Formula: C12H16O2
• Molecular Weight: 192.25424
• DSSTox Substance ID: DTXSID50479045
• Nikkaji Number: J1.881.925B
• Mol file: 504439-23-0.mol

Synonyms:504439-23-0;2,2,7-Trimethyl-2,6,7,8-tetrahydro-chromen-5-one;2,2,7-trimethyl-7,8-dihydro-6H-chromen-5-one;DTXSID50479045;AKOS006289306;2,2,7-Trimethyl-2,6,7,8-tetrahydro-5H-1-benzopyran-5-one

Chemical Property of 2,2,7-Trimethyl-2,6,7,8-tetrahydro-chromen-5-one

Chemical Property:

• Vapor Pressure: 0.00061mmHg at 25°C
• Refractive Index: 1.519
• Boiling Point: 310.2 °C at 760 mmHg
• Flash Point: 136.5 °C
• PSA: 26.30000
• Density: 1.06 g/cm³
• LogP: 2.60450
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 192.115029749
• Heavy Atom Count: 14
• Complexity: 334

Purity/Quality:

99% ^*data from raw suppliers

2,2,7-TRIMETHYL-2,6,7,8-TETRAHYDRO-CHROMEN-5-ONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC2=C(C=CC(O2)(C)C)C(=O)C1