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Merck
CN

685828

(R)-1-Phenylethanol

97%

Synonym(s):

(+)-α-Methylbenzyl alcohol, (+)-α-Phenethyl alcohol, (+)-α-Phenylethanol, (+)-1-Phenylethanol, (+)-1-Phenylethyl alcohol, (+)-sec-Phenethyl alcohol

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About This Item

Linear Formula:
C6H5CH(OH)CH3
CAS Number:
Molecular Weight:
122.16
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352002
MDL number:
Assay:
97%
Form:
liquid
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Quality Level

assay

97%

form

liquid

optical activity

[α]22/D +44.0°, c = 5%

refractive index

n20/D 1.528

density

0.9986 g/mL at 25 °C

functional group

hydroxyl, phenyl

SMILES string

C[C@@H](O)c1ccccc1

InChI

1S/C8H10O/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H3/t7-/m1/s1

InChI key

WAPNOHKVXSQRPX-SSDOTTSWSA-N

General description

(R)-1-Phenylethanol can be prepared from ethylbenzene via enantioselective hydroxylation of ethylbenzene catalyzed by peroxygenase enzyme.


pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 3

flash_point_f

185.0 °F - closed cup

flash_point_c

85 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter



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Peroxygenase-Catalyzed Oxyfunctionalization Reactions Promoted by the Complete Oxidation of Methanol.
Ni Y, et al.
Angewandte Chemie (International Edition in English), 55(2), 798-801 (2016)
Sachiko Sugimoto et al.
Phytochemistry, 108, 189-195 (2014-12-03)
Three aromatic glycosides (1-3), two sulfur and nitrogen-containing compound glucosides (4, 5), and one flavonoid glycoside (6) were isolated from the leaves of Ixora undulata. Their structures were established by extensive 1D, 2D NMR, and HRESIMS experiments, and structure 4



Global Trade Item Number

SKUGTIN
685828-5G04061832759203
685828-25G04061832759197