ETHYL ACETATE 99.5% AR/ACS

Name: ETHYL ACETATE 99.5% AR/ACS
Brand: Chempure

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CAS Number

141-78-6

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IUPAC name	ethyl acetate
canonical smiles	CCOC(=O)C
inchi	InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3
inchi key	XEKOWRVHYACXOJ-UHFFFAOYSA-N
molecular formula	C4H8O2
synonyms	ETHYL ACETATE 141-78-6 Ethyl ethanoate Acetic acid ethyl ester Acetoxyethane
Compound Description	Ethyl acetate appears as a clear colorless liquid with a fruity odor. Flash point 24 °F. Less dense than water. Vapors heavier than air. Ethyl acetate is the acetate ester formed between acetic acid and ethanol. It has a role as a polar aprotic solvent, an EC 3.4.19.3 inhibitor, a metabolite and a Saccharomyces cerevisiae metabolite. It is an acetate ester, an ethyl ester and a volatile organic compound. Ethyl Acetate is a natural product found in Angelica gigas, Plumeria rubra, and other organisms with data available. Ethyl acetate is a metabolite found in or produced by Saccharomyces cerevisiae.

Computed Properties

Molecular Weight:	88.11 g/mol
XLogP3:	0.7
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	2
Exact Mass:	88.052429494 g/mol
Monoisotopic Mass:	88.052429494 g/mol
Topological Polar Surface Area:	26.3 Å²
Heavy Atom Count:	6
Formal Charge:	0
Complexity:	49.5
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

hazard signal	Danger
hazard classes and categories	Flam. Liq. 2 (99.98%) Eye Irrit. 2 (91.3%) STOT SE 3 (100%) Flammable liquid - category 2 Specific target organ toxicity (single exposure) - category 3 Eye irritation - category 2A Flammable liquids - Category 2 Acute toxicity (Inhalation: Vapours) - Category 4 Serious eye damage/eye irritation - Category 2B Specific target organ toxicity - Single exposure - Category 3 (Respiratory tract irritation, Narcotic effects) Specific target organ toxicity - Single exposure - Category 1 (respiratory system), Category 3 (narcotic effects) Specific target organ toxicity - Single exposure - Category 3 (narcotic effects, respiratory tract irritation) Flammable - 3rd degree Flam. Liq. 2 STOT SE 3 Eye Irrit. 2
precautionary statement codes	P210, P233, P240, P241, P242, P243, P261, P264+P265, P271, P280, P303+P361+P353, P304+P340, P305+P351+P338, P319, P337+P317, P370+P378, P403+P233, P403+P235, P405, and P501
hazard statements	H225 (99.98%): Highly Flammable liquid and vapor [Danger Flammable liquids] H319 (91.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H336 (100%): May cause drowsiness or dizziness [Warning Specific target organ toxicity, single exposure; Narcotic effects]
hazards summary	Ethyl acetate is in the list of Some volatile substances which may be abused by inhalation published on the web site of the U.N. International Drug Control Programme, indicating its potential to cause narcosis in workers. An eye and respiratory tract irritant. Inhalation of high concentrations may cause CNS effects.

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About this item

IUPAC name	ethyl acetate
canonical smiles	CCOC(=O)C
inchi	InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3
inchi key	XEKOWRVHYACXOJ-UHFFFAOYSA-N
molecular formula	C4H8O2
synonyms	ETHYL ACETATE 141-78-6 Ethyl ethanoate Acetic acid ethyl ester Acetoxyethane
Compound Description	Ethyl acetate appears as a clear colorless liquid with a fruity odor. Flash point 24 °F. Less dense than water. Vapors heavier than air. Ethyl acetate is the acetate ester formed between acetic acid and ethanol. It has a role as a polar aprotic solvent, an EC 3.4.19.3 inhibitor, a metabolite and a Saccharomyces cerevisiae metabolite. It is an acetate ester, an ethyl ester and a volatile organic compound. Ethyl Acetate is a natural product found in Angelica gigas, Plumeria rubra, and other organisms with data available. Ethyl acetate is a metabolite found in or produced by Saccharomyces cerevisiae.

Computed Properties

Molecular Weight:	88.11 g/mol
XLogP3:	0.7
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	2
Exact Mass:	88.052429494 g/mol
Monoisotopic Mass:	88.052429494 g/mol
Topological Polar Surface Area:	26.3 Å²
Heavy Atom Count:	6
Formal Charge:	0
Complexity:	49.5
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

hazard signal	Danger
hazard classes and categories	Flam. Liq. 2 (99.98%) Eye Irrit. 2 (91.3%) STOT SE 3 (100%) Flammable liquid - category 2 Specific target organ toxicity (single exposure) - category 3 Eye irritation - category 2A Flammable liquids - Category 2 Acute toxicity (Inhalation: Vapours) - Category 4 Serious eye damage/eye irritation - Category 2B Specific target organ toxicity - Single exposure - Category 3 (Respiratory tract irritation, Narcotic effects) Specific target organ toxicity - Single exposure - Category 1 (respiratory system), Category 3 (narcotic effects) Specific target organ toxicity - Single exposure - Category 3 (narcotic effects, respiratory tract irritation) Flammable - 3rd degree Flam. Liq. 2 STOT SE 3 Eye Irrit. 2
precautionary statement codes	P210, P233, P240, P241, P242, P243, P261, P264+P265, P271, P280, P303+P361+P353, P304+P340, P305+P351+P338, P319, P337+P317, P370+P378, P403+P233, P403+P235, P405, and P501
hazard statements	H225 (99.98%): Highly Flammable liquid and vapor [Danger Flammable liquids] H319 (91.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H336 (100%): May cause drowsiness or dizziness [Warning Specific target organ toxicity, single exposure; Narcotic effects]
hazards summary	Ethyl acetate is in the list of Some volatile substances which may be abused by inhalation published on the web site of the U.N. International Drug Control Programme, indicating its potential to cause narcosis in workers. An eye and respiratory tract irritant. Inhalation of high concentrations may cause CNS effects.

Product No: EE3414

ETHYL ACETATE 99.5% AR/ACS

Product No: EE3414

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

About this item

Documentation

Certificate of Analysis

Require a Sample Certificate of Analysis (COA) ?

Reviews

Product No: EE3414

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?