948006-00-6 Purity
96%
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Specification
The molecular formula of ethyl 2,2-dimethyl-3-phenylpropionate is C13H18O2.
The synonyms of ethyl 2,2-dimethyl-3-phenylpropionate are ethyl 2,2-dimethyl-3-phenylpropanoate, 94800-92-7, ETHYL 2,2-DIMETHYL-3-PHENYLPROPIONATE, Ethyl2,2-dimethyl-3-phenylpropanoate, ETHYL2,2-DIMETHYL-3-PHENYLPROPIONATE.
The molecular weight of ethyl 2,2-dimethyl-3-phenylpropionate is 206.28 g/mol.
The IUPAC name of ethyl 2,2-dimethyl-3-phenylpropionate is ethyl 2,2-dimethyl-3-phenylpropanoate.
The InChI of ethyl 2,2-dimethyl-3-phenylpropionate is InChI=1S/C13H18O2/c1-4-15-12(14)13(2,3)10-11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3.
The InChIKey of ethyl 2,2-dimethyl-3-phenylpropionate is XJJKGOJHTCRWNX-UHFFFAOYSA-N.
The canonical SMILES of ethyl 2,2-dimethyl-3-phenylpropionate is CCOC(=O)C(C)(C)CC1=CC=CC=C1.
The CAS number of ethyl 2,2-dimethyl-3-phenylpropionate is 94800-92-7.
Yes, ethyl 2,2-dimethyl-3-phenylpropionate is a canonicalized compound.