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Substance Name: 5-Hexyn-2-one
RN: 2550-28-9
InChIKey: MQVQPQJPNZJTAY-UHFFFAOYSA-N

Molecular Weight

  • 96.1282
 
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Names and Synonyms

  • 5-Hexyn-2-one

Registry Numbers

CAS Registry Number

  • 2550-28-9

System Generated Number

  • 0002550289

Structure Descriptors

InChI

1S/C6H8O/c1-3-4-5-6(2)7/h1H,4-5H2,2H3

InChIKey

MQVQPQJPNZJTAY-UHFFFAOYSA-N

Smiles

C(#C)CCC(=O)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 149 deg C   EXP
log P (octanol-water) 0.58 (none)   EXP
Water Solubility 3.84E+04 mg/L 25 EST
Vapor Pressure 14 mm Hg 25 EST
Henry's Law Constant 1.44E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.16E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.