5655-61-8
Product Name:
L-BORNYL ACETATE
Formula:
C12H20O2
Synonyms:
endo-(1S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid; mp = 24 or 27 deg C; [Merck Index] Colorless or white clear liquid or crystals with a sweet, woody, fresh pine needle odor; mp = 27-29 deg C; [Good Scents MSDS] |
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Solubility | Practically insoluble to insoluble in water |
Density | 0.981-0.987 |
Vapor Pressure | 0.6 [mmHg] |
Refractive Index | 1.456-1.462 |
Kovats Retention Index | 1273 |
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 |
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. 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 | 3 |
Undefined Atom Stereocenter Count | 0 |
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 Grindelia hirsutula, Psidium guajava, and other organisms with data available.