22029-76-1
Product Name:
BETA-IONOL
Formula:
C13H22O
Synonyms:
4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-buten-2-ol;beta-Ionol
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | clear, colourless liquid |
|---|---|
| Boiling Point | 107.00 °C. @ 3.00 mm Hg |
| Density | 0.927-0.933 |
| Refractive Index | 1.499 |
| Kovats Retention Index | 1406 1406 1405 1407 |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H227:Flammable liquids H302:Acute toxicity,oral |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P270:Do not eat, drink or smoke when using this product. P280:Wear protective gloves/protective clothing/eye protection/face protection. P330:Rinse mouth. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P370+P378:In case of fire: Use … for extinction. P403+P235:Store in a well-ventilated place. Keep cool. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
| Molecular Weight | 194.31 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Exact Mass | 194.167065321 g/mol |
| Monoisotopic Mass | 194.167065321 g/mol |
| Topological Polar Surface Area | 20.2 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 258 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Beta-Ionol is a sesquiterpenoid.