Cas no 92444-14-9 (1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO-)

1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO- structure
92444-14-9 structure
Product Name:1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO-
CAS No:92444-14-9
MF:C19H27NS
MW:301.489383935928
CID:998483
PubChem ID:57649611
Update Time:2025-04-20

1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO- Chemical and Physical Properties

Names and Identifiers

    • 1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO-
    • 1-(4-hexylcyclohexyl)-4-isothiocyanatobenzene
    • 1-(trans-4-Hexylcyclohexyl)-4-isothiocyanatobenzene, liquid crystal (nematic), 99%
    • SCHEMBL3761250
    • AKOS015898389
    • 1-(4-hexyl-cyclohexyl)-4-isothiocyanato-benzene
    • SCHEMBL3761254
    • DTXSID90392603
    • 92444-14-9
    • 1-(trans-4-Hexylcyclohexyl)-4-isothiocyanatobenzene
    • MDL： MFCD00134324
    • 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
    • InChI Key： STLICVZWECVJDT-UHFFFAOYSA-N
    • SMILES： S=C=NC1C=CC(=CC=1)C1CCC(CCCCCC)CC1

Computed Properties

  • Exact Mass: 301.18642104g/mol
  • Monoisotopic Mass: 301.18642104g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 7
  • Complexity: 319
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 8.8
  • Topological Polar Surface Area: 44.4?2

Experimental Properties

  • Color/Form: Not determined
  • Density: 0.977?g/mL?at 25?°C(lit.)
  • Flash Point: Degrees Fahrenheit:235.4°F
    Degrees Celsius:113°C
  • Refractive Index: n20/D 1.532(lit.)

1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO- Security Information

1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
XI GE MA AO DE LI QI （ SHANG HAI ） MAO YI Co., Ltd.
366854-1G
1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO-
 92444-14-9 99%
1g
 ￥709.35 2023-12-07

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