CHEMICAL AND PHYSICAL PROPERTIES
Kovats Retention Index | 1318 |
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COMPUTED DESCRIPTORS
Molecular Weight | 150.22 g/mol |
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XLogP3 | 3.2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 2 |
Exact Mass | 150.104465066 g/mol |
Monoisotopic Mass | 150.104465066 g/mol |
Topological Polar Surface Area | 20.2 Ų |
Heavy Atom Count | 11 |
Formal Charge | 0 |
Complexity | 111 |
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
3,4-Diethylphenol is a natural product found in Mosla chinensis with data available.