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181465-11-2

181465-11-2 | Methyl 5-(4-chlorobenzylidene)-2,4-dioxo-1

CAS No: 181465-11-2 Catalog No: AG01FOH0 MDL No:

Product Description

Catalog Number:
AG01FOH0
Chemical Name:
Methyl 5-(4-chlorobenzylidene)-2,4-dioxo-1
CAS Number:
181465-11-2
IUPAC Name:
methyl 5-[(4-chlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidine-3-carboxylate
InChI:
InChI=1S/C12H8ClNO4S/c1-18-11(16)14-10(15)9(19-12(14)17)6-7-2-4-8(13)5-3-7/h2-6H,1H3
InChI Key:
NHCQXGMKPONWTA-UHFFFAOYSA-N

Properties

Complexity:
443  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.986g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.709g/mol
Monoisotopic Mass:
296.986g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
89A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.2  

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