Ethyl 6-fluoro-2-naphthoate

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Product Description

ProductEthyl 6-fluoro-2-naphthoate
CAS702640-90-2
FormulaC13H11FO2
SynonymEthyl 6-fluoro-2-naphthoate, 702640-90-2, ethyl 6-fluoronaphthalene-2-carboxylate, Ethyl6-fluoro-2-naphthoate, SCHEMBL3830381, DTXSID00739060, CDB64090, 6-fluoro-2-naphthoic acid ethyl ester

Typical Product Specifications

Standard InChIKeyTXJYDGYMUGPRED-UHFFFAOYSA-N
XLogP3-AA Log P3.5
Exact Mass218.07430775
Molecular Weight218.22
Canonical SMILESCCOC(=O)C1=CC2=C(C=C1)C=C(C=C2)F
Isomeric SMILESCCOC(=O)C1=CC2=C(C=C1)C=C(C=C2)F
Polar Surface Area Topological26.3
MonoIsotopic Weight218.07430775
Molecular FormulaC13H11FO2
Canonicalized Compound1
Compound Complexity254
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Allowed IUPAC Nameethyl 6-fluoronaphthalene-2-carboxylate
CAS-like Style IUPAC Name6-fluoro-2-naphthalenecarboxylic acid ethyl ester
Markup IUPAC Nameethyl 6-fluoronaphthalene-2-carboxylate
Preferred IUPAC Nameethyl 6-fluoronaphthalene-2-carboxylate
Systematic IUPAC Nameethyl 6-fluoranylnaphthalene-2-carboxylate
Traditional IUPAC Name6-fluoronaphthalene-2-carboxylic acid ethyl ester
Standard InChIInChI=1S/C13H11FO2/c1-2-16-13(15)11-4-3-10-8-12(14)6-5-9(10)7-11/h3-8H,2H2,1H3
Chemical StructureChemical Structure
ClassSpecialty Materials
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