Acetone-13C3

Base Information

• Chemical Name: Acetone-13C3
• CAS No.: 93628-01-4
• Molecular Formula: C3H6 O
• Molecular Weight: 61.047
• European Community (EC) Number: 685-092-6
• DSSTox Substance ID: DTXSID30465668
• Nikkaji Number: J1.748.283A
• Wikidata: Q82291808
• Mol file: 93628-01-4.mol

Synonyms:Acetone-13C3;93628-01-4;(1,2,3-13C3)propan-2-one;ACETONE (13C3);DTXSID30465668;2-Propanone-1,2,3-13c3(9ci);Acetone-13C3, 99 atom % 13C

Chemical Property of Acetone-13C3

Chemical Property:

• Melting Point: -94oC(lit.)
• Refractive Index: n20/D 1.359(lit.)
• Boiling Point: 56 °C(lit.)
• Flash Point: 1 °F
• PSA: 17.07000
• Density: 0.832 g/mL at 25 °C
• LogP: 0.59530
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 61.051929317
• Heavy Atom Count: 4
• Complexity: 26.3

Purity/Quality:

98% ^*data from raw suppliers

Acetone-13C3 99 atom % 13C ^*data from reagent suppliers

Safty Information:

• Hazard Codes: F
• Statements: 11-37/38-41
• Safety Statements: 9-16-23-33

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C
• Isomeric SMILES: [13CH3][13C](=O)[13CH3]