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91970-62-6

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91970-62-6 Structure

91970-62-6 Structure
IdentificationBack Directory
[Name]

benzyl 4-hydroxybutanoate
[CAS]

91970-62-6
[Synonyms]

benzyl 4-hydroxybutanoate
BENZYL4-HYDROXYBUTANOATE(WXC08681)
butanoic acid, 4-hydroxy-, phenylmethyl ester
benzyl 4-hydroxybutanoate ISO 9001：2015 REACH
[Molecular Formula]

C11H14O3
[MDL Number]

MFCD27932875
[MOL File]

91970-62-6.mol
[Molecular Weight]

194.23
Chemical PropertiesBack Directory
[Boiling point ]

322.8±25.0 °C(Predicted)
[density ]

1.124±0.06 g/cm3(Predicted)
[solubility ]

Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
[form ]

Oil
[pka]

14.85±0.10(Predicted)
[color ]

Clear Colorless
[InChI]

InChI=1S/C11H14O3/c12-8-4-7-11(13)14-9-10-5-2-1-3-6-10/h1-3,5-6,12H,4,7-9H2
[InChIKey]

CRXCATWWXVJNJF-UHFFFAOYSA-N
[SMILES]

C(OCC1=CC=CC=C1)(=O)CCCO
Hazard InformationBack Directory
[Uses]

4-Hydroxybutyric Acid Benzyl Ester is used to prepare pyridocarbazolecarboxylic acid amide derivatives with antitumor activities. It is also used to prepare 3-Carboxypropyl Phthalate(C181270), a metabolite of Dibutyl phthalate (DBP) (D429495), which is widely used in consumer products.
Spectrum DetailBack Directory
[Spectrum Detail]

benzyl 4-hydroxybutanoate(91970-62-6)1HNMR
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