CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colourless liquid; Green aroma |
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Solubility | Soluble in fats; Insoluble in water |
Density | 0.845-0.853 |
Refractive Index | 1.437-1.445 |
Kovats Retention Index | 827 850 837 837 847 856 856 827 854 853.8 855 855 855 855 863 847 845 846 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Flame Flammables GHS02 Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H226:Flammable liquids H319:Serious eye damage/eye irritation |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
Molecular Weight | 100.16 g/mol |
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XLogP3 | 1.4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 3 |
Exact Mass | 100.088815002 g/mol |
Monoisotopic Mass | 100.088815002 g/mol |
Topological Polar Surface Area | 20.2 Ų |
Heavy Atom Count | 7 |
Formal Charge | 0 |
Complexity | 48.1 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
cis-2-Hexen-1-ol is a natural product found in Cistus creticus, Carica papaya, and other organisms with data available.