Catalog No.:AA00IAZQ

62690-29-3 | Ethyl 3-phenylbutanoate

Name: Name:Ethyl 3-phenylbutanoate
Brand: AABLOCKS
SKU: AA00IAZQ
Availability: InStock
Rating: 90 (10 reviews)

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98%

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$211.00 $148.00

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98%

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$610.00 $427.00

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25g

98%

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$2,007.00 $1,405.00

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Technical Information
Properties
Literature
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Technical Information
Properties
Literature

Technical Information

Catalog Number:

AA00IAZQ

Chemical Name:

Ethyl 3-phenylbutanoate

CAS Number:

62690-29-3

Molecular Formula:

C12H16O2

Molecular Weight:

192.2542

MDL Number:

MFCD06204644

SMILES:

CCOC(=O)CC(c1ccccc1)C

Properties

Computed Properties

Complexity:

171

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Rotatable Bond Count:

Undefined Atom Stereocenter Count:

XLogP3:

2.9

Literature

Title: The crystal structure of an esterase from the hyperthermophilic microorganism Pyrobaculum calidifontis VA1 explains its enantioselectivity.

Journal: Applied microbiology and biotechnology 20110801

Title: Inverting enantioselectivity of Burkholderia cepacia KWI-56 lipase by combinatorial mutation and high-throughput screening using single-molecule PCR and in vitro expression.

Journal: Journal of molecular biology 20030815

Title: Mutations in distant residues moderately increase the enantioselectivity of Pseudomonas fluorescens esterase towards methyl 3bromo-2-methylpropanoate and ethyl 3phenylbutyrate.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20030509

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