CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colourless liquid; sweet musky animal odour with fruity balsamic undertone reminiscent of fresh cocoa beans |
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Boiling Point | 268.00 °C. @ 760.00 mm Hg |
Solubility | Insoluble in water; soluble in oils |
Density | 0.975-0.981 |
LogP | 3.870 |
Refractive Index | 1.483-1.490 |
Kovats Retention Index | 1477 1460 1468 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H315:Skin corrosion/irritation |
Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P332+P313:IF SKIN irritation occurs: Get medical advice/attention. |
COMPUTED DESCRIPTORS
Molecular Weight | 206.28 g/mol |
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XLogP3 | 3.6 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 6 |
Exact Mass | 206.130679813 g/mol |
Monoisotopic Mass | 206.130679813 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 15 |
Formal Charge | 0 |
Complexity | 181 |
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
3-Methylbutyl phenylacetate is a member of benzenes.