ISOPROPENYL ACETATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H8O2
Molecular Weight	100.1158
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=C)OC(C)=O

InChI

InChIKey=HETCEOQFVDFGSY-UHFFFAOYSA-N

InChI=1S/C5H8O2/c1-4(2)7-5(3)6/h1H2,2-3H3

HIDE SMILES / InChI

Molecular Formula	C5H8O2
Molecular Weight	100.1158
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Lipase-catalyzed irreversible transesterification of 1-(2-furyl)ethanol using isopropenyl acetate.	2001 Feb	11170255
Efficient lipase-catalyzed enantioselective desymmetrization of prochiral 2,2-disubstituted 1,3-propanediols and meso 1,2-diols using 1-ethoxyvinyl 2-furoate.	2002 Jan 25	11798311
Stereochemistry of a diastereoisomeric amphiphile and the species of the lipase influence enzyme activity in the transesterification catalyzed by a lipase-co-lyophilizate with the amphiphile in organic media.	2003 Nov	14677713
One-Pot synthesis of gamma,delta-unsaturated carbonyl compounds from allyl alcohols and vinyl or isopropenyl acetates catalyzed by [IrCl(cod)]2.	2006 Aug 4	16872222
Application and comparison of immobilized and coated amylose tris-(3,5-dimethylphenylcarbamate) chiral stationary phases for the enantioselective separation of beta-blockers enantiomers by liquid chromatography.	2006 Jan 15	18970363
Dynamic kinetic resolution of secondary alcohols combining enzyme-catalyzed transesterification and zeolite-catalyzed racemization.	2007	17004277
Air-stable racemization catalysts for the dynamic kinetic resolution of secondary alcohols.	2007 Aug 31	17691741
Large-scale ruthenium- and enzyme-catalyzed dynamic kinetic resolution of (rac)-1-phenylethanol.	2007 Dec 20	18096033
Enol esters: versatile substrates for Mannich-type multicomponent reactions.	2007 Oct 11	17867693
The allosteric modulation of lipases and its possible biological relevance.	2007 Sep 7	17825093
Inhibitory effect of some acetyl esters and acetamides on glycation of the histone H1.	2008 Jul-Aug	18810996
Large nonstatistical branching ratio in the dissociation of pentane-2,4-dione radical cation: an ab initio direct classical trajectory study.	2009 Feb 26	22893922

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:12:14 UTC 2023` Edited by `admin` on `Fri Dec 15 19:12:14 UTC 2023`
Record UNII	4AR9LAS337
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOPROPENYL ACETATE

Systematic Name

English

1-PROPEN-2-OL, ACETATE [HSDB]

Common Name

English

1-PROPEN-2-YL ACETATE

Systematic Name

English

ISOPROPENYL ACETATE [MI]

Common Name

English

FEMA NO. 4152

Code

English

1-PROPEN-2-OL 2-ACETATE

Common Name

English

NSC-2197

Code

English

Code System Code Type Description

JECFA MONOGRAPH

1813