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Home >> Chemical Listing >> Page 817 >> trans-4-Isothiocyanatocyclohexanol

trans-4-Isothiocyanatocyclohexanol
[CAS# 195073-94-0]

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Identification
Name trans-4-Isothiocyanatocyclohexanol
Synonyms (1r,4r)-4-isothiocyanatocyclohexanol
Molecular Structure CAS#: 195073-94-0, trans-4-Isothiocyanatocyclohexanol
Molecular Formula C7H11NOS
Molecular Weight 157.23
CAS Registry Number 195073-94-0
SMILES C1[C@@H](CC[C@H](C1)O)N=C=S
InChI 1S/C7H11NOS/c9-7-3-1-6(2-4-7)8-5-10/h6-7,9H,1-4H2/t6-,7-
InChIKey CPWGOWRPDPLJAC-LJGSYFOKSA-N
Properties
Density 1.2±0.1g/cm3 (Cal.)
Boiling point 290.5±29.0°C at 760 mmHg (Cal.)
Flash point 129.5±24.3°C (Cal.)
Refractive index 1.599 (Cal.)
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