CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Trans-squalene is a clear, slightly yellow liquid with a faint odor. Density 0.858 g / cm3. |
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Color/Form | Oil; crystals from ether/methanol (-5 °C) |
Odor | Faint agreeable odor |
Boiling Point | 545 °F at 25 mmHg (NTP, 1992) |
Melting Point | -103 °F (NTP, 1992) |
Flash Point | greater than 235 °F (NTP, 1992) |
Solubility | less than 1 mg/mL at 66 °F (NTP, 1992) |
Density | 0.8584 at 68 °F (NTP, 1992) - Less dense than water; will float |
Stability/Shelf Life | Stable under recommended storage conditions. |
Decomposition | When heated to decomposition it emits acrid smoke and irritating vapors. |
Viscosity | 12 cP at 25 °C |
Surface Tension | 33.9 mN/m at 22 °C (100 g/L) |
Refractive Index | Index of Refraction: 1.4990 at 20 °C |
Collision Cross Section | 210.9 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)] |
Kovats Retention Index | 2808 |
Other Experimental Properties | Absorbs oxygen and becomes viscous like linseed oil |
Chemical Classes | Other Uses -> Lubricants |
SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Health Hazard GHS08 |
GHS Hazard Statements |
H304:Aspiration hazard |
COMPUTED DESCRIPTORS
Molecular Weight | 410.7 g/mol |
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XLogP3 | 11.6 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 0 |
Rotatable Bond Count | 15 |
Exact Mass | 410.391251595 g/mol |
Monoisotopic Mass | 410.391251595 g/mol |
Topological Polar Surface Area | 0 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 578 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 4 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Trans-squalene is a clear, slightly yellow liquid with a faint odor. Density 0.858 g / cm3.