CHEMICAL AND PHYSICAL PROPERTIES
Boiling Point | 99.00 to 100.00 °C. @ 10.00 mm Hg |
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Kovats Retention Index | 1097 1100 1099 1089 1093 1104 1090 1079 1076 1103 1111 1105 1103 1104 1103 |
COMPUTED DESCRIPTORS
Molecular Weight | 154.25 g/mol |
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XLogP3 | 3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 5 |
Exact Mass | 154.135765193 g/mol |
Monoisotopic Mass | 154.135765193 g/mol |
Topological Polar Surface Area | 20.2 Ų |
Heavy Atom Count | 11 |
Formal Charge | 0 |
Complexity | 145 |
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
Myrcenol is a monoterpenoid that is oct-7-en-2-ol substituted by a methyl group at position 2 and a methylidene group at position 6 respectively. It has a role as a plant metabolite and a fragrance. It is a monoterpenoid and a tertiary alcohol.