ethyl (2Z)-5-phenyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-1,3-oxathiole-4-carboxylate
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ethyl (2Z)-5-phenyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-1,3-oxathiole-4-carboxylate
structure -
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CAS No:
1164518-57-3
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Formula:
C16H13F3O5S
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Chemical Name:
ethyl (2Z)-5-phenyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-1,3-oxathiole-4-carboxylate
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Synonyms:
SMR000147343;MLS000555626;ethyl (2Z)-5-phenyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-1,3-oxathiole-4-carboxylate;CHEMBL1409787;BDBM78590;C16H13F3O5S;cid_1604315;CHEBI:120976;HMS2340H10;ZINC13477484;AKOS030518345;(2Z)-2-(1-carbomethoxy-2,2,2-trifluoro-ethylidene)-5-phenyl-1,3-oxathiole-4-carboxylic acid ethyl ester;(2Z)-5-phenyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-1,3-oxathiole-4-carboxylic acid ethyl ester;(Z)-ethyl 5-phenyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-1,3-oxathiole-4-carboxylate;1164518-57-3;5-Phenyl-2-[2,2,2-trifluoro-1-methoxycarbonyl-eth-(Z)-ylidene]-[1,3]oxathiole-4-carboxylic acid ethyl ester;5-Phenyl-2-[2,2,2-trifluoro-1-methoxycarbonyl-eth-(Z)-ylidene]-[1,3]oxathiole-4-carboxylic acid ethyl ester;ethyl (2Z)-5-phenyl-2-[1,1,1-tris(fluoranyl)-3-methoxy-3-oxidanylidene-propan-2-ylidene]-1,3-oxathiole-4-carboxylate
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CAS No:
Description
5-phenyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-1,3-oxathiole-4-carboxylic acid ethyl ester is a cinnamate ester.
ethyl (2Z)-5-phenyl-2-(1,1,1-trifluoro-3-methoxy-3-oxopropan-2-ylidene)-1,3-oxathiole-4-carboxylate Basic Attributes
374.3 g/mol
374.04357917 g/mol
Computed Properties
Molecular Weight:374.3
XLogP3:3.8
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:374.04357917
Monoisotopic Mass:374.04357917
Topological Polar Surface Area:87.1
Heavy Atom Count:25
Complexity:603
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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