CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Dry Powder, Liquid; Liquid; Liquid, Other Solid; Other Solid |
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Color/Form | Colorless to very pale straw-colored liquid |
Odor | Pine needles |
Taste | Fresh, burning taste |
Boiling Point | 220-224 °C |
Flash Point | 190 °F (88 °C) /closed cup/ |
Solubility | Insoluble in water |
Density | 0.978 at °C |
Vapor Pressure | 0.6 [mmHg] |
LogP | log Kow = 4.30 |
Stability/Shelf Life | Stable under recommended storage conditions. |
Decomposition | When heated to decomposition it emits acrid smoke and irritating fumes. |
Refractive Index | Index of refraction: 1.462-1.465 at 20 °C |
Kovats Retention Index | 1595 |
Other Experimental Properties | Insoluble in water at 227 °C |
Chemical Classes | Other Classes -> Esters, Other |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H227:Flammable liquids H316:Skin corrosion/irritation |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P280:Wear protective gloves/protective clothing/eye protection/face protection. P332+P313:IF SKIN irritation occurs: Get medical advice/attention. P370+P378:In case of fire: Use … for extinction. P403+P235:Store in a well-ventilated place. Keep cool. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
Molecular Weight | 196.29 g/mol |
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XLogP3 | 3.3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 2 |
Exact Mass | 196.146329876 g/mol |
Monoisotopic Mass | 196.146329876 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 270 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 3 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Bornyl acetate is a natural product found in Xylopia aromatica, Xylopia sericea, and other organisms with data available.