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(Q105007903)
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English
(2S)-1-chloro-4-(5-thiophen-2-ylthiophen-2-yl)but-3-yn-2-ol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-{[2,2'-bithiophen]-5-yl}-1-chlorobut-3-yn-2-ol
1 reference
based on heuristic
inferred from SMILES
mass
267.978334588
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₉ClOS₂
0 references
canonical SMILES
ClCC(O)C#CC=1SC(=CC1)C=2SC=CC2
0 references
isomeric SMILES
O[C@@H](C#Cc1ccc(-c2cccs2)s1)CCl
0 references
found in taxon
Pterocaulon virgatum
1 reference
stated in
Thiophene acetylenes and flavanols from Pterocaulon virgatum
Identifiers
InChI
InChI=1S/C12H9ClOS2/c13-8-9(14)3-4-10-5-6-12(16-10)11-2-1-7-15-11/h1-2,5-7,9,14H,8H2/t9-/m0/s1
0 references
InChIKey
GFYWABYZRGXGNU-VIFPVBQESA-N
0 references
PubChem CID
162853513
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GFYWABYZRGXGNU-VIFPVBQESA-N
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