CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colorless liquid with a mild odor; [Alfa Aesar MSDS] |
---|---|
Kovats Retention Index | 1121 1126.52 1130.6 1133.26 1127 1139 1122 1147 1130 1134 1122 |
Chemical Classes | Solvents -> Aliphatics, Saturated (<C12) |
SAFETY INFORMATION
Signal word | Warning |
---|---|
Pictogram(s) |
Environment GHS09 |
GHS Hazard Statements |
H227:Flammable liquids H400:Hazardous to the aquatic environment, acute hazard H410:Hazardous to the aquatic environment, long-term hazard |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P391:Collect spillage. Hazardous to the aquatic environment 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 | 154.29 g/mol |
---|---|
XLogP3 | 5.7 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 0 |
Rotatable Bond Count | 4 |
Exact Mass | 154.172150702 g/mol |
Monoisotopic Mass | 154.172150702 g/mol |
Topological Polar Surface Area | 0 Ų |
Heavy Atom Count | 11 |
Formal Charge | 0 |
Complexity | 80 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
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
Pentylcyclohexane is a natural product found in Chrysanthemum indicum with data available.