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Flavanone

CAT: 0572-TRC-F371100-10GSize: 10 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-F371100-10GSize:10 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
487-26-3
Synonyms
Propafenone Hydrochloride Imp. H (EP); Propafenone Imp. H (EP); (2RS)-2-Phenyl-2,3-dihydro-4H-1-benzopyran-4-one; Propafenone Hydrochloride Impurity H; Propafenone Impurity H
Hazard Statement
No Data Available
Smiles
O=C1CC(Oc2ccccc12)c3ccccc3
Molecular Formula
C15 H12 O2
Molecular Weight
224.25
InChI
InChI=1S/C15H12O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-9,15H,10H2
Additionnal Information
IUPAC name: 2-phenyl-2,3-dihydrochromen-4-one
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Flavanone

Flavanone is the simplest member of the class of flavanones that consists of flavan bearing an oxo substituent at position 4. It derives from a hydride of a flavan.

CAS Number487-26-3
PubChem CID10251
IUPAC Name2-phenyl-2,3-dihydrochromen-4-one
Molecular FormulaC15H12O2
Molecular Weight224.25
XLogP3.2
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count17
Formal Charge0
Complexity281
SMILES
C1C(OC2=CC=CC=C2C1=O)C3=CC=CC=C3
InChI
InChI=1S/C15H12O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-9,15H,10H2
InChIKey
ZONYXWQDUYMKFB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Flavanone
CAS: 487-26-3
CID: 10251
Formula: C15H12O2
MW: 224.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight224.25
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass224.083729621
Monoisotopic Mass224.083729621
Topological Polar Surface Area26.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity281
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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