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NSC 31153

CAT: 0013-GTR19201735-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19201735-02Size:5 mg
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Description
NSC 31153
CAS Number
6325-94-6
Field of Research
Cell Biology, Neuroscience
Purity
99.89% (May vary between batches)
Smiles
O=C1SC (=CC=2C=CC=CC2O) C (=O) N1
Molecular Formula
C10H7NO3S
Molecular Weight
221.23
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-(2-Hydroxybenzylidene)thiazolidine-2,4-dione

See also: 5-(2-Hydroxy-benzylidene)-thiazolidine-2,4-dione (annotation moved to).

CAS Number6325-94-6
PubChem CID6070143
IUPAC Name(5Z)-5-[(2-hydroxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
Molecular FormulaC10H7NO3S
Molecular Weight221.23
XLogP1.8
Topological Polar Surface Area91.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count15
Formal Charge0
Complexity327
SMILES
C1=CC=C(C(=C1)/C=C\2/C(=O)NC(=O)S2)O
InChI
InChI=1S/C10H7NO3S/c12-7-4-2-1-3-6(7)5-8-9(13)11-10(14)15-8/h1-5,12H,(H,11,13,14)/b8-5-
InChIKey
IZVVCHFDGJEVTB-YVMONPNESA-N
Chemical Structure
2D Structure
2D structure of 5-(2-Hydroxybenzylidene)thiazolidine-2,4-dione
CAS: 6325-94-6
CID: 6070143
Formula: C10H7NO3S
MW: 221.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight221.23
XLogP31.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass221.01466426
Monoisotopic Mass221.01466426
Topological Polar Surface Area91.7 Ų
Heavy Atom Count15
Formal Charge0
Complexity327
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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