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2-Butyl-1-Phenylbutane-1,3-Dione
[CAS# 10225-39-5]

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Identification
Name 2-Butyl-1-Phenylbutane-1,3-Dione
Synonyms 2-Butyl-1-Phenyl-Butane-1,3-Dione; 1,3-Butanedione, 2-Butyl-1-Phenyl-; Nsc406960
Molecular Structure CAS#: 10225-39-5, 2-Butyl-1-Phenylbutane-1,3-Dione
Molecular Formula C14H18O2
Molecular Weight 218.30
CAS Registry Number 10225-39-5
SMILES C1=CC=C(C=C1)C(=O)C(C(=O)C)CCCC
InChI 1S/C14H18O2/c1-3-4-10-13(11(2)15)14(16)12-8-6-5-7-9-12/h5-9,13H,3-4,10H2,1-2H3
InChIKey UHORPYVBTFVDPA-UHFFFAOYSA-N
Properties
Density 1.004g/cm3 (Cal.)
Boiling point 320.816°C at 760 mmHg (Cal.)
Flash point 120.158°C (Cal.)
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