FT-0614654 CAS:107-54-0 chemical structure
FT-0614654 CAS:107-54-0 chemical structure

3,5-DIMETHYL-1-HEXYN-3-OL

Catalog No:   FT-0614654

CAS No:   107-54-0

  • Molecular Formula:  126.2
  • Formula Weight: C8H14O
  • Inchl Key: NECRQCBKTGZNMH-UHFFFAOYSA-N
  • Inchl: InChI=1S/C8H14O/c1-5-8(4,9)6-7(2)3/h1,7,9H,6H2,2-4H3
Assay Pack Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
Melting_Point: N/A
CAS: 107-54-0
MF: C8H14O
Flash_Point: 44.4±0.0 °C
Product_Name: UNII:Q988C9BDWK
Density: 0.9±0.1 g/cm3
FW: 126.196
Bolling_Point: 152.6±8.0 °C at 760 mmHg
Refractive_Index: 1.452
Vapor_Pressure: 1.3±0.6 mmHg at 25°C
Flash_Point: 44.4±0.0 °C
LogP: 1.73
Bolling_Point: 152.6±8.0 °C at 760 mmHg
FW: 126.196
PSA: 20.23000
Vapor_Density: 4.34 (vs air)
Computational_Chemistry: ['1. XlogP :16 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :9 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :129 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
MF: C8H14O
Exact_Mass: 126.104462
Molecular_Structure: ['1 . Molar refractive index 3839 ', '2 . Molar volume 1422 ', '3 . Parachor （902K）3386 ', '4 . Surface tension 320 ', '5 . Dielectric constant ', '6 偶极距（10-24cm3） ', '7 . Polarizability 1522']
Density: 0.9±0.1 g/cm3
More_Info: ['1 . Appearance Colourless Liquid 。 ', '2 . Density（g/mL,20/20℃）08545 ', '3 . Relative vapor density（g/mL,Atmosphere =1）434 ', '4 . Melting point（ºC）-68 ', '5 . Boiling point（ºC,Atmospheric pressure）150-151 ', '6 . Refractive index（20ºC）1434 ', '7 . Flash point（ºC）44 ', '8 . Vapor pressure（mmHg, 20ºC）45 ', '9 . Solubility 微Soluble in Water 。']
Hazard_Class: 3.2
Risk_Statements(EU): R10
WGK_Germany: 3
RIDADR: UN 1986 3/PG 3
Hazard_Codes: T: Toxic;
HS_Code: 2905290000
Safety_Statements: S16-S26-S36/37/39-S45
Packing_Group: III

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