Octyl cyanoacetate
Names
[ CAS No. ]:
15666-97-4
[ Name ]:
Octyl cyanoacetate
[Synonym ]:
2-cyanoacetic acid octyl ester
Octyl cyanoacetate
Acetic acid, 2-cyano-, octyl ester
octylcyanoacetate
MFCD00075425
octyl 2-cyanoethanoate
n-Octyl cyanoacetate
Chemical & Physical Properties
[ Density]:
1.0±0.1 g/cm3
[ Boiling Point ]:
323.7±0.0 °C at 760 mmHg
[ Molecular Formula ]:
C11H19NO2
[ Molecular Weight ]:
197.274
[ Flash Point ]:
109.5±5.2 °C
[ Exact Mass ]:
197.141586
[ PSA ]:
50.09000
[ LogP ]:
3.25
[ Vapour Pressure ]:
0.0±0.7 mmHg at 25°C
[ Index of Refraction ]:
1.441
[ Storage condition ]:
2-8°C
MSDS
Safety Information
[ Symbol ]:
GHS07
[ Signal Word ]:
Warning
[ Hazard Statements ]:
H302-H312-H315-H319-H332-H335
[ Precautionary Statements ]:
P261-P280-P305 + P351 + P338
[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
[ Hazard Codes ]:
Xn:Harmful;
[ Risk Phrases ]:
R20/21/22;R36/37/38
[ Safety Phrases ]:
S26-S37/39
[ RIDADR ]:
UN 2810
[ WGK Germany ]:
3
[ Packaging Group ]:
III
[ Hazard Class ]:
6.(b)
[ HS Code ]:
2926909090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2926909090
[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
Articles
J. Am. Chem. Soc. 134(39) , 16345-51, (2012)
Small molecules, namely, DCAO(3)TBDT and DR(3)TBDT, with 2-ethylhexoxy substituted BDT as the central building block and octyl cyanoacetate and 3-ethylrhodanine as different terminal units with the sa...
A planar small molecule with dithienosilole core for high efficiency solution-processed organic photovoltaic cells. Zhou J, et al.Chem. Mater. 23(21) , 4666-68, (2011)