Structure

Tioxaprofen

CAS
40198-53-6
Catalog Number
ACM40198536
Category
Other Products
Molecular Weight
394.271720 [g/mol]
Molecular Formula
C18H13Cl2NO3S

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Specification

Synonyms
tioxaprofen;2-[[4,5-Bis(4-chlorophenyl)oxazol-2-yl]thio]propanoic acid;2-[[4,5-Bis(4-chlorophenyl)oxazol-2-yl]thio]propionic acid;EMD-26644
IUPAC Name
2-[[4,5-bis(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanyl]propanoic acid
Canonical SMILES
CC(C(=O)O)SC1=NC(=C(O1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl
InChI Key
WGDADRBTCPGSDG-UHFFFAOYSA-N
Boiling Point
536ºC at 760mmHg
Flash Point
278ºC
Density
1.49g/cm³
EC Number
254-834-7
Exact Mass
392.99900
H-Bond Acceptor
5
H-Bond Donor
1
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