CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | clear, colourless liquid |
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Boiling Point | 95.00 °C. @ 30.00 mm Hg |
Density | 0.876-0.880 |
Refractive Index | 1.428-1.434 |
Kovats Retention Index | 1233.5 1224 1231 1240 1231 1218 1247 1217 1191 1231 |
COMPUTED DESCRIPTORS
Molecular Weight | 184.27 g/mol |
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XLogP3 | 3.3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 7 |
Exact Mass | 184.146329876 g/mol |
Monoisotopic Mass | 184.146329876 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 13 |
Formal Charge | 0 |
Complexity | 162 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Cis-3-Hexenyl 2-methylbutanoate is a fatty acid ester.