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* Service & Products of Interested: [Isotope Labeled Building Blocks] 4-Phenylbutyric Acid-[13C6] (1346602-38-7)
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4-Phenylbutyric Acid-[13C6]

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General Information
Catalog: BLP-002969
CAS: 1346602-38-7
Molecular Formula: C4[13C]6H12O2
Molecular Weight: 170.16

Chemical Structure

Synonyms	4-Phenylbutyric Acid-13C6; Benzene-13C6-butanoic Acid; γ-Phenyl-13C6-butanoic Acid
IUPAC Name	4-((1,2,3,4,5,6-13C6)cyclohexatrienyl)butanoic acid
Related CAS	1821-12-1 (unlabelled)
Canonical SMILES	C1=CC=C(C=C1)CCCC(=O)O
InChI	InChI=1S/C10H12O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)/i1+1,2+1,3+1,5+1,6+1,9+1
InChI Key	OBKXEAXTFZPCHS-SJOJKWQCSA-N
Melting Point	48-50 °C
Purity	≥ 98% by HPLC; ≥ 99% atom 13C
Solubility	Slightly soluble in Chloroform, Methanol
Appearance	White to Off-white Solid
Storage	2-8 °C