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4-Butyl-1-Phenyl-2,6,7-Trioxabicyclo[2.2.2]Octane
[CAS# 70637-01-3]

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Identification
Name 4-Butyl-1-Phenyl-2,6,7-Trioxabicyclo[2.2.2]Octane
Synonyms 2,6,7-Trioxabicyclo(2.2.2)Octane, 4-Butyl-1-Phenyl-; Orthobenzoic Acid, Cyclic Ester With 2-Butyl-2-(Hydroxymethyl)-1,3-Propanediol
Molecular Structure CAS#: 70637-01-3, 4-Butyl-1-Phenyl-2,6,7-Trioxabicyclo[2.2.2]Octane
Molecular Formula C15H20O3
Molecular Weight 248.32
CAS Registry Number 70637-01-3
SMILES C1=CC=CC=C1C23OCC(CO2)(CO3)CCCC
InChI 1S/C15H20O3/c1-2-3-9-14-10-16-15(17-11-14,18-12-14)13-7-5-4-6-8-13/h4-8H,2-3,9-12H2,1H3
InChIKey HKBXBUSPPGNWTA-UHFFFAOYSA-N
Properties
Density 1.127g/cm3 (Cal.)
Boiling point 326.247°C at 760 mmHg (Cal.)
Flash point 109.294°C (Cal.)
Market Analysis Reports
List of Reports Available for 4-Butyl-1-Phenyl-2,6,7-Trioxabicyclo[2.2.2]Octane
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