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Naproxen Impurity 55

CAT: 1299-RM-N162455-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-N162455-02Size:25 mg
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CAS Number
17056-94-9
Synonyms
1- (3-methoxynaphthalen-2-yl) ethan-1-one
Molecular Formula
C13H12O2
Molecular Weight
200.24
Target Alternative Name
Naproxen
Product Name Synonym
1- (3-methoxynaphthalen-2-yl) ethan-1-one

Chemical Information

1-(3-Methoxy-2-naphthalenyl)ethanone
CAS Number17056-94-9
PubChem CID10726702
IUPAC Name1-(3-methoxynaphthalen-2-yl)ethanone
Molecular FormulaC13H12O2
Molecular Weight200.23
XLogP2.8
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity237
SMILES
CC(=O)C1=CC2=CC=CC=C2C=C1OC
InChI
InChI=1S/C13H12O2/c1-9(14)12-7-10-5-3-4-6-11(10)8-13(12)15-2/h3-8H,1-2H3
InChIKey
RNZWDMFJUYOHAA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(3-Methoxy-2-naphthalenyl)ethanone
CAS: 17056-94-9
CID: 10726702
Formula: C13H12O2
MW: 200.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight200.23
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass200.083729621
Monoisotopic Mass200.083729621
Topological Polar Surface Area26.3 Ų
Heavy Atom Count15
Formal Charge0
Complexity237
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