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7-Methoxyquinolin-2 (1H) -one

CAT: 0127-OR1033561-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1033561-01Size:100 mg
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CAS Number
23981-26-2
Purity
98%
Smiles
O=C1NC2=C(C=CC(OC)=C2)C=C1

Chemical Information

7-Methoxy-1,2-dihydroquinolin-2-one
CAS Number23981-26-2
PubChem CID29942756
IUPAC Name7-methoxy-1H-quinolin-2-one
Molecular FormulaC10H9NO2
Molecular Weight175.18
XLogP1.2
Topological Polar Surface Area38.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity237
SMILES
COC1=CC2=C(C=C1)C=CC(=O)N2
InChI
InChI=1S/C10H9NO2/c1-13-8-4-2-7-3-5-10(12)11-9(7)6-8/h2-6H,1H3,(H,11,12)
InChIKey
AUHADULCABPIFC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-Methoxy-1,2-dihydroquinolin-2-one
CAS: 23981-26-2
CID: 29942756
Formula: C10H9NO2
MW: 175.18
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight175.18
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass175.063328530
Monoisotopic Mass175.063328530
Topological Polar Surface Area38.3 Ų
Heavy Atom Count13
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

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Alternative Products

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