00873
(R)-α-Acetoxyphenylacetonitrile
≥97.0% (sum of enantiomers, GC)
Synonym(s):
(R)-α-Cyanobenzyl acetate, O-Acetyl-D-mandelonitrile
Sign In to View Organizational & Contract Pricing.
Select a Size
Change View
About This Item
Empirical Formula (Hill Notation):
C10H9NO2
CAS Number:
Molecular Weight:
175.18
UNSPSC Code:
12352108
NACRES:
NA.22
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
4293296
assay
≥97.0% (sum of enantiomers, GC)
optical activity
[α]20/D +8.0±0.5°, c = 10% in chloroform
refractive index
n20/D 1.506
density
1.115 g/mL at 20 °C (lit.)
SMILES string
CC(=O)O[C@@H](C#N)c1ccccc1
InChI
1S/C10H9NO2/c1-8(12)13-10(7-11)9-5-3-2-4-6-9/h2-6,10H,1H3/t10-/m0/s1
InChI key
MUXDFYRMYMEGCM-JTQLQIEISA-N
Application
(R)-α-Acetoxyphenylacetonitrile can be used as a model compound in the iodine promoted as well as t-BuONO-assisted secondary amides synthesis via an aryl N-addition reaction to the -CN group of nitriles.
signalword
Warning
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
wgk
WGK 3
flash_point_f
235.4 °F - closed cup
flash_point_c
113 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Storage Class
10 - Combustible liquids
Choose from one of the most recent versions:
Already Own This Product?
Find documentation for the products that you have recently purchased in the Document Library.
Iodine-mediated aryl transfer reaction from arylhydrazine hydrochlorides to nitriles
Zhang Z, et al.
Tetrahedron, 75(26), 3628-3635 (2019)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 8420250025 | 04027269057343 |
| 8420250005 | 04027269057336 |
| 00873-1ML | 04061838607812 |