CHEMICAL AND PHYSICAL PROPERTIES
Kovats Retention Index | 1056 1063 1053 1053 1053 1055 1062 1058 1059 1054 1062 1062 1056 1056 1054 1056 1057 1072 1098 1054 1061 1054 1071 1054 1086 1067 1053 1055 1053 1054 1055 1055 1059 1051 1051 1051 1054 1055 1046.4 1045 1051.2 |
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COMPUTED DESCRIPTORS
Molecular Weight | 136.19 g/mol |
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XLogP3 | 1.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 1 |
Exact Mass | 136.100048391 g/mol |
Monoisotopic Mass | 136.100048391 g/mol |
Topological Polar Surface Area | 25.8 Ų |
Heavy Atom Count | 10 |
Formal Charge | 0 |
Complexity | 103 |
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-Ethyl-2,5-dimethylpyrazine is a natural product found in Streptomyces antioxidans, Corynebacterium glutamicum, and Sulfitobacter pontiacus with data available.