88-09-5
Product Name:
2-Ethylbutyric acid
Formula:
C6H12O2
Synonyms:
2-Ethylbutyric acid;Diethylacetic acid
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colorless liquid; [Merck Index] Colorless liquid with a rancid odor; [Acros Organics MSDS] |
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Boiling Point | 99.00 to 101.00 °C. @ 18.00 mm Hg |
Melting Point | -15 °C |
Solubility | 18 mg/mL at 20 °C |
Density | 0.917-0.922 |
Vapor Pressure | 0.18 [mmHg] |
LogP | 1.68 |
Refractive Index | 1.413 |
Chemical Classes | Other Classes -> Organic Acids |
SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Skull and Crossbones Acute Toxicity GHS06 Health Hazard GHS08 |
GHS Hazard Statements |
H311:Acute toxicity,dermal H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H373:Specific target organ toxicity, repeated exposure |
Precautionary Statement Codes |
P260:Do not breathe dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P280:Wear protective gloves/protective clothing/eye protection/face protection. P314:Get medical advice/attention if you feel unwell. 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 | 116.16 g/mol |
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XLogP3 | 1.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 3 |
Exact Mass | 116.083729621 g/mol |
Monoisotopic Mass | 116.083729621 g/mol |
Topological Polar Surface Area | 37.3 Ų |
Heavy Atom Count | 8 |
Formal Charge | 0 |
Complexity | 74.6 |
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
2-Ethylbutanoic acid is a branched-chain fatty acid.