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ethyl (2E)-2-(1-cyano-2,2,2-trifluoroethylidene)-5-phenyl-1,3-oxathiole-4-carboxylate

ethyl (2E)-2-(1-cyano-2,2,2-trifluoroethylidene)-5-phenyl-1,3-oxathiole-4-carboxylate structure

CAS No:
1164537-61-4
Formula:
C15H10F3NO3S
Chemical Name:
ethyl (2E)-2-(1-cyano-2,2,2-trifluoroethylidene)-5-phenyl-1,3-oxathiole-4-carboxylate
Synonyms:
MLS000556838;SMR000147955;ethyl (2E)-2-(1-cyano-2,2,2-trifluoroethylidene)-5-phenyl-1,3-oxathiole-4-carboxylate;2-[1-Cyano-2,2,2-trifluoro-eth-(E)-ylidene]-5-phenyl-[1,3]oxathiole-4-carboxylic acid ethyl ester;CHEMBL1453212;BDBM43375;cid_1883255;REGID_for_CID_1883255;ZINC521954;STL338523;AKOS022108056;(2E)-2-(1-cyano-2,2,2-trifluoro-ethylidene)-5-phenyl-1,3-oxathiole-4-carboxylic acid ethyl ester;(2E)-2-(1-cyano-2,2,2-trifluoroethylidene)-5-phenyl-1,3-oxathiole-4-carboxylic acid ethyl ester;1164537-61-4;ethyl (2E)-2-[1-cyano-2,2,2-tris(fluoranyl)ethylidene]-5-phenyl-1,3-oxathiole-4-carboxylate

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ethyl (2E)-2-(1-cyano-2,2,2-trifluoroethylidene)-5-phenyl-1,3-oxathiole-4-carboxylate Basic Attributes

Molecular Weight：

341.3 g/mol

Exact Mass：

341.03334884 g/mol

Characteristics

PSA：

84.6 Å²

Computed Properties

Molecular Weight:341.3
XLogP3:3.6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:341.03334884
Monoisotopic Mass:341.03334884
Topological Polar Surface Area:84.6
Heavy Atom Count:23
Complexity:595
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl (2E)-2-(1-cyano-2,2,2-trifluoroethylidene)-5-phenyl-1,3-oxathiole-4-carboxylate

Basic Attributes
Characteristics
Computed Properties
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