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749920-38-5 | 2-[2-(furan-2-yl)-2-oxoethylidene]-1,3-thiazolidin-4-one
CAS No: 749920-38-5 Catalog No: AG019JMY MDL No:MFCD06336998
Product Description
Catalog Number:
AG019JMY
Chemical Name:
2-[2-(furan-2-yl)-2-oxoethylidene]-1,3-thiazolidin-4-one
CAS Number:
749920-38-5
Molecular Formula:
C9H7NO3S
Molecular Weight:
209.2218
MDL Number:
MFCD06336998
IUPAC Name:
2-[2-(furan-2-yl)-2-oxoethylidene]-1,3-thiazolidin-4-one
InChI:
InChI=1S/C9H7NO3S/c11-6(7-2-1-3-13-7)4-9-10-8(12)5-14-9/h1-4H,5H2,(H,10,12)
InChI Key:
XALRCXXRWJXPSZ-UHFFFAOYSA-N
SMILES:
O=C1CSC(=CC(=O)c2ccco2)N1
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.015g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.219g/mol
Monoisotopic Mass:
209.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.9
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