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309974

Ethyl (S)-(+)-mandelate

Name: Ethyl (<I>S</I>)-(+)-mandelate
Brand: ALDRICH

99%, optical purity ee: 99% (GLC)

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About This Item

Linear Formula:

C₆H₅CH(OH)CO₂C₂H₅

CAS Number:

13704-09-1

Molecular Weight:

180.20

NACRES:

NA.22

PubChem Substance ID:

24858761

UNSPSC Code:

12352108

MDL number:

MFCD00064249

Assay:

99%

Form:

solid

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Properties

assay

99%

form

solid

optical activity

[α]21/D +134°, c = 3 in chloroform

optical purity

ee: 99% (GLC)

bp

106-107 °C/4 mmHg (lit.)

mp

32-34 °C (lit.)

functional group

ester, hydroxyl, phenyl

SMILES string

CCOC(=O)[C@@H](O)c1ccccc1

InChI

1S/C10H12O3/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7,9,11H,2H2,1H3/t9-/m0/s1

InChI key

SAXHIDRUJXPDOD-VIFPVBQESA-N

Description

Application

Ethyl (S)-(+)-mandelate can be used as a starting material for the preparation of N-benzyl 2-phenylacetamide derivatives, which are known as potent anticonvulsant agents.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

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