2,2-Dimethyl-3-phenylpentanoate

ChemSpider ID: 21105992
Molecular Formula: C₁₃H₁₇O₂
Average mass: 205.273407 Da
Monoisotopic mass: 205.123398 Da
Systematic name

2,2-Dimethyl-3-phenylpentanoate
SMILES and InChIs

SMILES:

CCC(c1ccccc1)C(C)(C)C([O-])=O Copied

Std. InChI:

InChI=1S/C13H18O2/c1-4-11(13(2,3)12(14)15)10-8-6-5-7-9-10/h5-9,11H,4H2,1-3H3,(H,14,15)/p-1 Copied

Std. InChIKey:

PDPFHMHNMDCZDO-UHFFFAOYSA-M Copied
Cite this record
CSID:21105992, http://www.chemspider.com/Chemical-Structure.21105992.html (accessed 13:14, Jun 19, 2013) Copied

Names and Identifiers

Data supplied by datasources and users.

Experimental Physico-chemical Properties

Experimental Boiling Point:

258 °C Food and Agriculture Organization of the United Nations 2-Phenylpropyl-2-methylpropanoate

Experimental Refraction Index:

1.482-1.488 Food and Agriculture Organization of the United Nations 2-Phenylpropyl-2-methylpropanoate

Miscellaneous

Appearance:

Colourless liquid; Fruity floral aroma Food and Agriculture Organization of the United Nations 2-Phenylpropyl-2-methylpropanoate

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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