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824969-44-0 | Ethanone, 1-[2-(2-furanyl)-2-thiazolidinyl]-
CAS No: 824969-44-0 Catalog No: AG008J1F MDL No:
Product Description
Catalog Number:
AG008J1F
Chemical Name:
Ethanone, 1-[2-(2-furanyl)-2-thiazolidinyl]-
CAS Number:
824969-44-0
Molecular Formula:
C9H11NO2S
Molecular Weight:
197.2541
IUPAC Name:
1-[2-(furan-2-yl)-1,3-thiazolidin-2-yl]ethanone
InChI:
InChI=1S/C9H11NO2S/c1-7(11)9(10-4-6-13-9)8-3-2-5-12-8/h2-3,5,10H,4,6H2,1H3
InChI Key:
DDQYSYGAQPCZSF-UHFFFAOYSA-N
SMILES:
CC(=O)C1(NCCS1)c1ccco1
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.051g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.252g/mol
Monoisotopic Mass:
197.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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