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 |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 140.22 g/mol |
|---|---|
| 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.