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Merck
CN

469742

(R)-(+)-4-Chloromandelonitrile

97%

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About This Item

Linear Formula:
ClC6H4CH(OH)CN
CAS Number:
Molecular Weight:
167.59
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352101
MDL number:
Assay:
97%
Form:
solid
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Product Name

(R)-(+)-4-Chloromandelonitrile, 97%

InChI

1S/C8H6ClNO/c9-7-3-1-6(2-4-7)8(11)5-10/h1-4,8,11H/t8-/m0/s1

SMILES string

O[C@@H](C#N)c1ccc(Cl)cc1

InChI key

LSDSHEPNJSMUTI-QMMMGPOBSA-N

assay

97%

form

solid

optical activity

[α]20/D +39°, c = 1 in chloroform

mp

70-74 °C (lit.)

storage temp.

2-8°C

Application

Useful intermediate in the preparation of optically active α-hydroxy carboxylic acids, α-hydroxy aldehydes, α-hydroxy ketones, and 2-amino alcohols.

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Kruse, C.G. In Collins, A.N. Sheldrake, G.N. Crosby, J., Eds.
Chirality in Industry, 279-279 (1992)

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