591-80-0
Product Name:
Allylacetic acid
Formula:
C5H8O2
Synonyms:
3-Vinylpropionic acid;Allylacetic acid;Propargylacetic acid
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Liquid |
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Melting Point | -22.5 °C |
Solubility | slightly soluble in water; soluble in alcohol and ether |
Density | 0.970-0.990 (20°) |
Refractive Index | 1.425-1.431 |
SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Corrosion Corrosives GHS05 Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H302:Acute toxicity,oral H314:Skin corrosion/irritation |
Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P330+P331:IF SWALLOWED: Rinse mouth. Do NOT induce vomiting. P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower. |
COMPUTED DESCRIPTORS
Molecular Weight | 100.12 g/mol |
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XLogP3 | 0.8 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 3 |
Exact Mass | 100.052429494 g/mol |
Monoisotopic Mass | 100.052429494 g/mol |
Topological Polar Surface Area | 37.3 Ų |
Heavy Atom Count | 7 |
Formal Charge | 0 |
Complexity | 76.1 |
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
Pent-4-enoic acid is a pentenoic acid having the double bond at position 4. It is a conjugate acid of a pent-4-enoate.