106-35-4
Product Name:
3-Heptanone
Formula:
C7H14O
Synonyms:
Butyl ethyl ketone;Ethyl butyl ketone
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Ethyl butyl ketone is a colorless odorless liquid with a mild fruity odor. Flash point 140 °F. |
|---|---|
| Color/Form | Clear liquid |
| Odor | GREEN ODOR |
| Taste | MELON, BANANA FLAVOR |
| Boiling Point | 297 °F at 760 mmHg (USCG, 1999) |
| Melting Point | -38 °F (USCG, 1999) |
| Flash Point | 115 °F (USCG, 1999) |
| Solubility | 1 % (NIOSH, 2023) |
| Density | 0.818 (USCG, 1999) - Less dense than water; will float |
| Vapor Density | 3.93 (Air = 1) |
| Vapor Pressure | 4 mmHg (NIOSH, 2023) |
| Viscosity | 0.84 cP at 20 °C |
| Heat of Vaporization | 36.61 kJ/mol at 101.3 kPa |
| Ionization Potential | 9.02 eV |
| Odor Threshold | Odor Threshold Low: 0.1 [mmHg] Odor Threshold High: 10.0 [mmHg] Odor threshold from "Quick Guide: The Electronic NIOSH Pocket Guide to Chemical Hazards" |
| Refractive Index | Index of refraction: 1.4057 at 20 °C/D |
| Kovats Retention Index | 865.8 865 865 867 867 866.2 866.5 871 847 866 868 860 865 869 865 869.2 865 869.42 866 863.1 869 865 869 869 860 862 866 |
| Other Experimental Properties | Air pollution factors: 1 mg/cu m = 0.214 ppm, 1 ppm = 4.66 mg/cu m |
| Chemical Classes | Solvents -> Ketones (<C12) |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02  Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H226:Flammable liquids H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H332:Acute toxicity,inhalation |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P233:Keep container tightly closed. P240:Ground/bond container and receiving equipment. P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower. 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 | 114.19 g/mol |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 4 |
| Exact Mass | 114.104465066 g/mol |
| Monoisotopic Mass | 114.104465066 g/mol |
| Topological Polar Surface Area | 17.1 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 66.8 |
| 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
Ethyl butyl ketone is a colorless odorless liquid with a mild fruity odor. Flash point 140 °F.