4'-Cyano-4-hexyloxybiphenyl
Catalog Number
ACM41424117-2
CAS
41424-11-7
IUPAC Name
4-(4-hexoxyphenyl)benzonitrile
Synonyms
4'-Hexyloxy-4-biphenylcarbonitrile
6OCB
6OCB
Molecular Weight
279.38
Molecular Formula
C19H21NO
Product Information
Canonical SMILES
CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
InChI
InChI=1S/C19H21NO/c1-2-3-4-5-14-21-19-12-10-18(11-13-19)17-8-6-16(15-20)7-9-17/h6-13H,2-5,14H2,1H3
InChI Key
YUYXUPYNSOFWFV-UHFFFAOYSA-N
Boiling Point
430.5 °C / 760 mmHg
Melting Point
58 °C
Flash Point
109 °C(228.2 °F)
Purity
>98.0%(GC)
Solubility
soluble in Toluene
Appearance
White to Almost white powder to crystal
Storage
Sealed in dry. Room temperature.
Complexity
316
Exact Mass
279.162314g/mol
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
21
MDL Number
MFCD00134145
Monoisotopic Mass
279.162314g/mol
Precautionary Statements
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.
Reaxys Registry Number
2216640
Refractive Index
1.53
Rotatable Bond Count
7
Signal Word
Warning
Specific Gravity
1.02
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