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Ethyl Paraben-[d4]

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General Information
Catalog: BLP-010818
CAS: 1219795-53-5
Molecular Formula: C9H6D4O3
Molecular Weight: 170.20

Chemical Structure

Description	Ethyl Paraben-[d4] is the labelled analogue of Ethyl Paraben, which is an antimicrobial agent used in cosmetic products.
Synonyms	Ethyl Paraben D4; 4-hydroxybenzoic-d4 Acid Ethyl Ester; 4-(Ethoxycarbonyl)phenol-d4; 4-Carbethoxyphenol-d4; Aseptin A-d4; Aseptoform E-d4; Easeptol-d4; Ethyl 4-Hydroxybenzoate-d4; Ethyl Butex-d4; Mekkings E-d4; Mycocten-d4; NSC 23514-d4; p-Carbethoxyphenol-d4
IUPAC Name	ethyl 2,3,5,6-tetradeuterio-4-hydroxybenzoate
Related CAS	120-47-8 (unlabelled)
Canonical SMILES	CCOC(=O)C1=CC=C(C=C1)O
InChI	InChI=1S/C9H10O3/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3/i3D,4D,5D,6D
InChI Key	NUVBSKCKDOMJSU-LNFUJOGGSA-N
Melting Point	115-117°C
Purity	≥98%; ≥99% atom D
Solubility	Slightly soluble in Chloroform, Ethyl Acetate
Appearance	White to Off-white Solid
Storage	Store at 2-8°C