713-95-1
Product Name:
delta-Dodecalactone
Formula:
C12H22O2
Synonyms:
(±)-δ-Heptyl-δ-valerolactone;(±)-5-Dodecanolide;(±)-6-Heptyltetrahydro-2H-pyran-2-one;5-Hydroxydodecanoic acid δ-lactone
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Liquid |
|---|---|
| Color/Form | COLORLESS TO VERY PALE STRAW-YELLOW LIQUID; VISCOUS |
| Odor | POWERFUL, FRESH-FRUIT, OILY ODOR |
| Taste | CREAMY TASTE |
| Melting Point | -12 °C |
| Solubility | INSOL IN WATER |
| Density | 0.942-0.950 |
| Refractive Index | 1.458-1.461 |
| Kovats Retention Index | 1670 1725 1675 1675 |
| Chemical Classes | Other Classes -> Lactones |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
| Molecular Weight | 198.30 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Exact Mass | 198.161979940 g/mol |
| Monoisotopic Mass | 198.161979940 g/mol |
| Topological Polar Surface Area | 26.3 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 166 |
| 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
Xi-5-Dodecanolide is a delta-lactone.