Acetic acid, trifluoro-, 1-methylethenyl ester structure

Acetic acid, trifluoro-, 1-methylethenyl ester

prop-1-en-2-yl 2,2,2-trifluoroacetate

Also Known As: i-propenyl trifluoroacetate|1-Methylvinyl trifluoroacetate|Isopropenyl trifluoroacetate #|Prop-1-en-2-yl trifluoroacetate|Acetic acid, trifluoro-, 1-methylethenyl ester|prop-1-en-2-yl 2,2,2-trifluoroacetate|Trifluoroaceticacid1-methylethenylester|Acetic acid, trifluoro-, isopropenyl ester|Trifluoroacetic acid 1-methylethenyl ester

CAS: 400-39-5
Molecular Formula C5H5F3O2
Molecular Weight 154.02417 g/mol
LogP 2.1
Topological Polar Surface Area 26.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 2
Exact Mass 154.02417
Monoisotopic Mass 154.02417
Heavy Atoms 10
Complexity 159.0

Chemical Identifiers

CAS Number 400-39-5
SMILES CC(=C)OC(=O)C(F)(F)F
InChIKey DGGGGOPPYLQQRC-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (6 patents) Polymer Intermediates (1 patents)

Product Overview

Acetic acid, trifluoro-, 1-methylethenyl ester (CAS 400-39-5), with molecular formula C5H5F3O2 and molecular weight 154.02417 g/mol. IUPAC: prop-1-en-2-yl 2,2,2-trifluoroacetate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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