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Butyl Paraben-[d9]

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General Information
Catalog: BLP-002118
CAS: 1216904-65-2
Molecular Formula: C11H5D9O3
Molecular Weight: 203.28

Chemical Structure

Synonyms	4-Hydroxybenzoic Acid Butyl-d9 Ester; 4-(Butoxy-d9-carbonyl)phenol; 4-Hydroxybenzoic Acid Butyl-d9 Ester; Aseptoform Butyl-d9; Butoben-d9; Butyl-d9 4-Hydroxybenzoate; Butyl-d9 Butex; Butyl-d9 Tegosept-d9; Butyl-d9 Chemosept; n-Butylparaben-d9; Preserval B-d9; SPF-d9; Solbrol B-d9; Butyl-d9 Paraben
IUPAC Name	1,1,2,2,3,3,4,4,4-nonadeuteriobutyl 4-hydroxybenzoate
Related CAS	94-26-8 (unlabelled)
Canonical SMILES	CCCCOC(=O)C1=CC=C(C=C1)O
InChI	InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7,12H,2-3,8H2,1H3/i1D3,2D2,3D2,8D2
InChI Key	QFOHBWFCKVYLES-WRMMWXQOSA-N
Boiling Point	309.2±15.0 °C at 760 mmHg
Melting Point	64-69°C
Purity	98% (CP); 99% atom D
Density	1.1±0.1 g/cm3
Solubility	Soluble in DMSO, Methanol
Appearance	Off-white Solid
Storage	Store at -20°C