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Benzoic Acid Ethyl Ester-[d5]

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General Information
Catalog: BLP-003425
CAS: 54354-03-9
Molecular Formula: C9H5D5O2
Molecular Weight: 155.21

Chemical Structure

Description	Benzoic Acid Ethyl Ester-[d5] is a labelled form of Benzoic Acid Ethyl Ester. Ethyl benzoate is the ester formed by the condensation of benzoic acid and ethanol. It has a pleasant odor described as sweet, wintergreen, fruity, medicinal, cherry, and grape. It is a component of some fragrances and artificial fruit flavors.
Synonyms	ethyl (D5)benzoate
IUPAC Name	ethyl 2,3,4,5,6-pentadeuteriobenzoate
Related CAS	93-89-0 (unlabelled)
Canonical SMILES	CCOC(=O)C1=CC=CC=C1
InChI	InChI=1S/C9H10O2/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3/i3D,4D,5D,6D,7D
InChI Key	MTZQAGJQAFMTAQ-DKFMXDSJSA-N
Purity	> 98%
Solubility	Soluble in Chloroform
Appearance	Clear Oil