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4-Isothiocyanatophenyl 4-pentylbicyclo

Catalog Number
ACM121235903
Product Name
4-Isothiocyanatophenyl 4-pentylbicyclo
Structure
CAS
121235-90-3
Category
Liquid Crystal (LC) Materials
Synonyms
4-ISOTHIOCYANATOPHENYL 4-PENTYLBICYCLO;4-isothiocyanatophenyl 4-pentylbicyclo (2.2.2)oct;4-isothiocyanatophenyl 4-pentylbicyclo[2.2.2]octane-1-carb
IUPAC Name
(4-isothiocyanatophenyl) 1-pentylbicyclo[2.2.2]octane-4-carboxylate
Molecular Weight
357.515
Molecular Formula
C21H27NO2S
Canonical SMILES
CCCCCC12CCC(CC1)(CC2)C(=O)OC3=CC=C(C=C3)N=C=S
InChI Key
BXZVNXOHCXCVAG-UHFFFAOYSA-N
Boiling Point
468.9ºC at 760mmHg
Melting Point
73-113.5ºC(lit.)
Flash Point
237.4ºC
Purity
96%
Density
1.14g/cm³
Exact Mass
357.17600
Hazard Statements
Xi: Irritant;
Safety Description
26-37/39
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