CHEMICAL AND PHYSICAL PROPERTIES
Boiling Point | 246.50 °C. @ 760.00 mm Hg |
---|---|
Melting Point | 29.00 to 30.00 °C. @ 760.00 mm Hg |
Kovats Retention Index | 1354 1353 1348 1367 1367 1348 1344 |
COMPUTED DESCRIPTORS
Molecular Weight | 192.25 g/mol |
---|---|
XLogP3 | 3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 3 |
Exact Mass | 192.115029749 g/mol |
Monoisotopic Mass | 192.115029749 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 199 |
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
5-Isopropyl-2-methylphenol acetate is a monoterpenoid.