378615
3,3-Diethoxypropionitrile
95%
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About This Item
Linear Formula:
(C2H5O)2CHCH2CN
CAS Number:
Molecular Weight:
143.18
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
217-988-6
MDL number:
Assay:
95%
Form:
liquid
assay
95%
form
liquid
refractive index
n20/D 1.415 (lit.)
bp
91-93 °C/11 mmHg (lit.)
density
0.954 g/mL at 25 °C (lit.)
functional group
ether, nitrile
SMILES string
CCOC(CC#N)OCC
InChI
1S/C7H13NO2/c1-3-9-7(5-6-8)10-4-2/h7H,3-5H2,1-2H3
InChI key
WBOXEOCWOCJQNK-UHFFFAOYSA-N
General description
3,3-Diethoxypropionitrile is a cyanide derivative. It undergoes reaction with urea in refluxing butanolic sodium butoxide to afford 4-amino-2(1H)-pyrimidinone and cytosine. Its physical properties (density, refractive index, boiling point and melting point) have been reported.
Application
3,3-Diethoxypropionitrile may be used in the synthesis of 2-(2,2-diethoxy-ethyl)-pyridine, via [2+2+2]-cycloaddition reaction. It may be used in the synthesis of cyanomalondialdehyde.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
10 - Combustible liquids
wgk
WGK 2
flash_point_f
183.2 °F - closed cup
flash_point_c
84 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
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