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4-Cyano-4'-octylbiphenyl

Catalog Number
52709-84-9
CAS
52709-84-9
IUPAC Name
4-(4-octylphenyl)benzonitrile
Synonyms
4'-OCTYL-4-BIPHENYLNITRILE; 4-OCTYL-4'-CYANO-BIPHENYL; 4'-OCTYL-4-BIPHENYLCARBONITRILE; 4'-OCTYL-BIPHENYL-4-CARBONITRILE; 4-CYANO-4'-OCTYLBIPHENYL; 4-CYANO-4-OCTYLBIPHENYL
Molecular Weight
291.43
Molecular Formula
C21H25N
Chemical structural formula

Product Information

Purity
97%
MDL
MFCD00075146
Physical State
Solid
Appearance
liquid crystal
Storage
Room temperature.
Boiling Point
433.9ºC at 760 mmHg
Melting Point
30 °C
Flash Point
113 °C(235.4 °F)
Density
1 g/cm3

Safety Information

Signal Word
Warning
Precautionary Statement
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
WGK Germany
3
Canonical SMILES
CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
InChI
InChI=1S/C21H25N/c1-2-3-4-5-6-7-8-18-9-13-20(14-10-18)21-15-11-19(17-22)12-16-21/h9-16H,2-8H2,1H3
InChI Key
CSQPODPWWMOTIY-UHFFFAOYSA-N