470-99-5
Product Name:
3,5,5-TRIMETHYL-2-CYCLOHEXEN-1-OL
Formula:
C9H16O
Synonyms:
Isophorol
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Kovats Retention Index | 1147 |
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COMPUTED DESCRIPTORS
Molecular Weight | 140.22 g/mol |
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XLogP3 | 1.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 0 |
Exact Mass | 140.120115130 g/mol |
Monoisotopic Mass | 140.120115130 g/mol |
Topological Polar Surface Area | 20.2 Ų |
Heavy Atom Count | 10 |
Formal Charge | 0 |
Complexity | 156 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
3,5,5-Trimethyl-2-cyclohexen-1-ol is a natural product found in Nicotiana tabacum with data available.