141-97-9
![141-97-9 structural image](https://img.chemicalbook.in/CAS/GIF/141-97-9.gif)
Product Name:
Ethyl acetoacetate
Formula:
C6H10O3
Synonyms:
Acetoacetic ester;EAA;EAA, Acetoacetic acid ethyl ester;Ethyl 3-oxobutanoate;Ethyl acetoacetate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Ethyl acetoacetate appears as a colorless liquid with a fruity odor. Flash point 185 °F. Boiling point 365 °F. May cause adverse health effects if ingested or inhaled. May irritate to skin, eyes and mucous membranes. Used in organic synthesis and in lacquers and paints. |
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Color/Form | COLORLESS LIQUID |
Odor | PLEASANT GREEN, FRUITY, RUM ODOR |
Taste | RIPE FRUIT TASTE |
Boiling Point | 363 °F at 760 mmHg (USCG, 1999) |
Melting Point | less than -112 °F (USCG, 1999) |
Flash Point | 135 °F (USCG, 1999) |
Solubility | SOL IN ABOUT 35 PARTS WATER |
Density | 1.028 at 68 °F (USCG, 1999) - Denser than water; will sink |
Vapor Density | 4.48 |
Vapor Pressure | 0.78 [mmHg] |
LogP | log Kow = 0.25 |
Autoignition Temperature | 563 °F (USCG, 1999) |
Refractive Index | MAX ABSORPTION (ALCOHOL): 248 NM (LOG E= 3.2); INDEX OF REFRACTION: 1.4194 AT 20 °C/D; SADTLER REFERENCE NUMBER: 101 (IR, PRISM) |
Kovats Retention Index | 903 910 907 907 |
Other Experimental Properties | CONVERSION FACTOR: 5.31 MG/CU M IS EQUIVALENT TO 1 PPM |
Chemical Classes | Other Classes -> Esters, Other |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
![]() Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H227:Flammable liquids H303:Acute toxicity,oral H319:Serious eye damage/eye irritation |
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. P280:Wear protective gloves/protective clothing/eye protection/face protection. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P337+P313:IF eye irritation persists: Get medical advice/attention. 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 | 130.14 g/mol |
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XLogP3 | 0.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 4 |
Exact Mass | 130.062994177 g/mol |
Monoisotopic Mass | 130.062994177 g/mol |
Topological Polar Surface Area | 43.4 Ų |
Heavy Atom Count | 9 |
Formal Charge | 0 |
Complexity | 118 |
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 acetoacetate appears as a colorless liquid with a fruity odor. Flash point 185 °F. Boiling point 365 °F. May cause adverse health effects if ingested or inhaled. May irritate to skin, eyes and mucous membranes. Used in organic synthesis and in lacquers and paints.