122-67-8
Product Name:
Isobutyl cinnamate
Formula:
C13H16O2
Synonyms:
2-methylpropyl 3-phenylpropenoate;2-Methylpropyl cinnamate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colourless liquid, sweet fruity balsamic odour |
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Solubility | insoluble in water; soluble in oils |
Density | 1.001-1.005 |
Refractive Index | 1.538-1.542 |
Kovats Retention Index | 1598 1619 1601 1604.6 1598 |
COMPUTED DESCRIPTORS
Molecular Weight | 204.26 g/mol |
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XLogP3 | 4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 5 |
Exact Mass | 204.115029749 g/mol |
Monoisotopic Mass | 204.115029749 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 15 |
Formal Charge | 0 |
Complexity | 213 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Isobutyl cinnamate is a cinnamate ester.