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Home >> Chemical Listing >> Page 2605 >> 3-(2-Methylbenzyl)-2,4-pentanedione

3-(2-Methylbenzyl)-2,4-pentanedione
[CAS# 791809-51-3]

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Identification
Name 3-(2-Methylbenzyl)-2,4-pentanedione
Synonyms 3-(2-methylbenzyl)pentane-2,4-dione
Molecular Structure CAS#: 791809-51-3, 3-(2-Methylbenzyl)-2,4-pentanedione
Molecular Formula C13H16O2
Molecular Weight 204.26
CAS Registry Number 791809-51-3
SMILES Cc1ccccc1CC(C(=O)C)C(=O)C
InChI 1S/C13H16O2/c1-9-6-4-5-7-12(9)8-13(10(2)14)11(3)15/h4-7,13H,8H2,1-3H3
InChIKey JYKGBHHJWYORHZ-UHFFFAOYSA-N
Properties
Density 1.026g/cm3 (Cal.)
Boiling point 306.493°C at 760 mmHg (Cal.)
Flash point 114.583°C (Cal.)
Refractive index 1.506 (Cal.)
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