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Ethyl oxanilate

CAT: 0024-sc-228074Size: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-228074Size:5 g
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CAS Number
1457-85-8

Chemical Information

Ethyl oxanilate
CAS Number1457-85-8
PubChem CID73826
IUPAC Nameethyl 2-anilino-2-oxoacetate
Molecular FormulaC10H11NO3
Molecular Weight193.20
XLogP1.5
Topological Polar Surface Area55.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity209
SMILES
CCOC(=O)C(=O)NC1=CC=CC=C1
InChI
InChI=1S/C10H11NO3/c1-2-14-10(13)9(12)11-8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H,11,12)
InChIKey
YDGAUBHNAKCSKF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethyl oxanilate
CAS: 1457-85-8
CID: 73826
Formula: C10H11NO3
MW: 193.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight193.20
XLogP31.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass193.07389321
Monoisotopic Mass193.07389321
Topological Polar Surface Area55.4 Ų
Heavy Atom Count14
Formal Charge0
Complexity209
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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