CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Isopropyl phenylacetate is a clear pale yellow liquid. (NTP, 1992) |
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Boiling Point | 486 to 489 °F at 760 mmHg (NTP, 1992) |
Flash Point | 203 °F (NTP, 1992) |
Solubility | less than 1 mg/mL at 68.9 °F (NTP, 1992) |
Density | 1.3 at 70.7 °F (NTP, 1992) - Denser than water; will sink |
Refractive Index | 1.483-1.491 |
Kovats Retention Index | 1266 |
COMPUTED DESCRIPTORS
Molecular Weight | 178.23 g/mol |
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XLogP3 | 2.6 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 4 |
Exact Mass | 178.099379685 g/mol |
Monoisotopic Mass | 178.099379685 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 13 |
Formal Charge | 0 |
Complexity | 158 |
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
Isopropyl phenylacetate is a clear pale yellow liquid. (NTP, 1992)