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2’-(2,3-Epoxypropoxy)-3-phenylpropiophenone

CAT: 0572-TRC-E589700-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-E589700-250MGSize:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
22525-95-7
Synonyms
1-[2-[[(2RS)-Oxiranyl]methoxy]phenyl]-3-phenylpropan-1-one; Propafenone Hydrochloride Imp. C (EP); Propafenone Imp. C (EP); 1-[2-[[(2RS)-Oxiranyl]methoxy]phenyl]-3-phenylpropan-1-one; Propafenone Hydrochloride Impurity C; Propafenone Impurity C
Hazard Statement
Harmful if swallowed
Purity
>95% (HPLC)
Smiles
O=C(CCc1ccccc1)c2ccccc2OCC3CO3
Molecular Formula
C18 H18 O3
Molecular Weight
282.33
InChI
InChI=1S/C18H18O3/c19-17(11-10-14-6-2-1-3-7-14)16-8-4-5-9-18(16)21-13-15-12-20-15/h1-9,15H,10-13H2
Additionnal Information
IUPAC name: 1-[2-(oxiran-2-ylmethoxy)phenyl]-3-phenylpropan-1-one
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

2'-(Oxiranylmethoxy)-3-phenylpropiophenone
CAS Number22525-95-7
PubChem CID90797
IUPAC Name1-[2-(oxiran-2-ylmethoxy)phenyl]-3-phenylpropan-1-one
Molecular FormulaC18H18O3
Molecular Weight282.3
XLogP3.2
Topological Polar Surface Area38.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count21
Formal Charge0
Complexity335
SMILES
C1C(O1)COC2=CC=CC=C2C(=O)CCC3=CC=CC=C3
InChI
InChI=1S/C18H18O3/c19-17(11-10-14-6-2-1-3-7-14)16-8-4-5-9-18(16)21-13-15-12-20-15/h1-9,15H,10-13H2
InChIKey
AUZMQKJKLUZHBY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2'-(Oxiranylmethoxy)-3-phenylpropiophenone
CAS: 22525-95-7
CID: 90797
Formula: C18H18O3
MW: 282.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight282.3
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass282.125594432
Monoisotopic Mass282.125594432
Topological Polar Surface Area38.8 Ų
Heavy Atom Count21
Formal Charge0
Complexity335
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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Alternative Products

CatalogName
274980-012'- (2,3-Epoxypropoxy) -3-phenylpropiophenone
0112302’- (2,3-Epoxypropoxy) -3-phenylpropiophenone
MBS6031645-012'-(2,3-Epoxypropoxy)-3-phenylpropiophenone
0112312’- (2,3-Epoxypropoxy) -3-phenylpropiophenone-d5
MBS6046711-012'-(2,3-Epoxypropoxy)-3-phenylpropiophenone-d5
sc-2162962'-Hydroxy-3-phenylpropiophenone
sc-4911072′-Hydroxy-3-phenylpropiophenone-d5
sc-266835A3-Phenylpropiophenone
sc-2093652'- (2,3-Epoxypropoxy) -3-phenyl-propiophenone
274983-014- (2,3-Epoxypropoxy) carbazole

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