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Oxazolone

CAT: 0013-GTR19168648-02Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19168648-02Size:1 ml x 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Oxazolone is a hapten used to model Th1/Th2-mediated inflammatory conditions like colitis and atopic dermatitis in vivo. It is a valuable tool for studying inflammatory bowel disease pathogenesis and therapeutic interventions, including anti-cytokine strategies, in both murine and zebrafish systems.
CAS Number
15646-46-5
Product Name Alternative
Oxazolone, 4-Ethoxymethylene-2-phenyl-2-oxazolin-5-one
Purity
95.74% (May vary between batches)
Solubility
10% DMSO+90% Saline:2.5 mg/mL (11.51 mM) ; DMSO:250 mg/mL (1150.91 mM)
Smiles
CCOC=C1N=C (OC1=O) c1ccccc1
Molecular Formula
C12H11NO3
Molecular Weight
217.22
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Oxazolone

Immunologic adjuvant and sensitizing agent.

CAS Number15646-46-5
PubChem CID1712094
IUPAC Name(4Z)-4-(ethoxymethylidene)-2-phenyl-1,3-oxazol-5-one
Molecular FormulaC12H11NO3
Molecular Weight217.22
XLogP2.1
Topological Polar Surface Area47.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count16
Formal Charge0
Complexity327
SMILES
CCO/C=C\1/C(=O)OC(=N1)C2=CC=CC=C2
InChI
InChI=1S/C12H11NO3/c1-2-15-8-10-12(14)16-11(13-10)9-6-4-3-5-7-9/h3-8H,2H2,1H3/b10-8-
InChIKey
SJHPCNCNNSSLPL-NTMALXAHSA-N
Chemical Structure
2D Structure
2D structure of Oxazolone
CAS: 15646-46-5
CID: 1712094
Formula: C12H11NO3
MW: 217.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight217.22
XLogP32.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass217.07389321
Monoisotopic Mass217.07389321
Topological Polar Surface Area47.9 Ų
Heavy Atom Count16
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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Alternative Products

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MBS3609863-01Oxazolone
419006-012-Oxazolone
BAA199012-Phenyl-5-oxazolone
D4925734,5-Diphenyl-2(3H)-oxazolone
D3440-104- (3,4-Diacetoxybenzal) -2-methyl-5-oxazolone
D3068754-(3,4-Diacetoxybenzal)-2-methyl-5-oxazolone
abx185246-015(4H)-Oxazolone,2-ethenyl-4,4-dimethyl-
sc-2670924- (4-Chlorobenzylidene) -2-methyl-5-oxazolone
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