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Oxazole

CAT: 1299-RG-O240103-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-O240103-02Size:25 mg
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CAS Number
288-42-6
Synonyms
Oxazole
Molecular Formula
C3H3NO
Molecular Weight
69.06
Product Name Synonym
Oxazole

Chemical Information

Oxazole

1,3-oxazole is a five-membered monocyclic heteroarene that is an analogue of cyclopentadiene with O in place of CH2 at position 1 and N in place of CH at position 3. It is a mancude organic heteromonocyclic parent, a monocyclic heteroarene and a member of 1,3-oxazoles.

CAS Number288-42-6
PubChem CID9255
IUPAC Name1,3-oxazole
Molecular FormulaC3H3NO
Molecular Weight69.06
XLogP0.1
Topological Polar Surface Area26
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count5
Formal Charge0
Complexity30
SMILES
C1=COC=N1
InChI
InChI=1S/C3H3NO/c1-2-5-3-4-1/h1-3H
InChIKey
ZCQWOFVYLHDMMC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Oxazole
CAS: 288-42-6
CID: 9255
Formula: C3H3NO
MW: 69.06
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight69.06
XLogP30.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass69.021463719
Monoisotopic Mass69.021463719
Topological Polar Surface Area26 Ų
Heavy Atom Count5
Formal Charge0
Complexity30.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
HY-34631-01Oxazole
HY-117445Oxazole yellow
AR-C07905-01Clethodim Oxazole
S01YF-0223-KX311Oxazole Gold
S01YF-0223-KX312Oxazole Red
T87082-01Oxazole blue
TRC-E588903-50MGOxazole-4-carbohydrazide
286259-01Oxazole-2-amine
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