92444-14-9

Name 1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO-
CAS 92444-14-9
Molecular Formula C19H27NS
MDL Number MFCD00134324
Molecular Weight 301.49
MOL File 92444-14-9.mol

Chemical Properties

Melting point  12.6 °C
Boiling point  418.5±24.0 °C(Predicted)
density  0.977 g/mL at 25 °C (lit.)
refractive index  n20/D 1.532(lit.)
Fp  113 °C
form  liquid crystal (nematic)
InChI 1S/C19H27NS/c1-2-3-4-5-6-16-7-9-17(10-8-16)18-11-13-19(14-12-18)20-15-21/h11-14,16-17H,2-10H2,1H3/t16-,17-
InChIKey STLICVZWECVJDT-QAQDUYKDSA-N
SMILES CCCCCC[C@H]1CC[C@@H](CC1)c2ccc(cc2)N=C=S

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302+H312+H332-H315-H319-H335
Precautionary statements  P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338
Hazard Codes  Xn
Risk Statements 
Safety Statements 
WGK Germany  3
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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