3,3-Dimethyl-2-hexanone

Base Information

• Chemical Name: 3,3-Dimethyl-2-hexanone
• CAS No.: 26118-38-7
• Molecular Formula: C8H16 O
• Molecular Weight: 128.214
• Hs Code.: 2914190090
• DSSTox Substance ID: DTXSID20180752
• Nikkaji Number: J110.707K
• Wikidata: Q83051356
• Mol file: 26118-38-7.mol

Synonyms:3,3-DIMETHYL-2-HEXANONE;26118-38-7;3,3-dimethylhexan-2-one;2-Hexanone, 3,3-dimethyl-;3,3-dimethyl-hexan-2-one;3,3-Dimethyl-2-hexanone #;SCHEMBL859738;DTXSID20180752;LJZPWSZYYTUCDP-UHFFFAOYSA-N;AKOS006324321

Chemical Property of 3,3-Dimethyl-2-hexanone

Chemical Property:

• Vapor Pressure: 3.94mmHg at 25°C
• Melting Point: -32.24°C (estimate)
• Refractive Index: 1.4098
• Boiling Point: 149.9°Cat760mmHg
• Flash Point: 34.4°C
• PSA: 17.07000
• Density: 0.812g/cm³
• LogP: 2.40170
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 128.120115130
• Heavy Atom Count: 9
• Complexity: 103

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(C)(C)C(=O)C