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2- (2-Fluorophenyl) -N'-hydroxyethanimidamide

CAT: 0926-XJB36189-02Size: 5 gDry Ice: NoHazardous: No
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CAT#:0926-XJB36189-02Size:5 g
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CAS Number
872361-89-2
MDL Number
MFCD07776511
Smiles
C1=CC=C (C (=C1) CC (=NO) N) F
Molecular Formula
C8H9FN2O
Molecular Weight
168.17 g/mol
Controlled
No

Chemical Information

2-(2-fluorophenyl)-N'-hydroxyethanimidamide
CAS Number872361-89-2
PubChem CID24688411
IUPAC Name2-(2-fluorophenyl)-N'-hydroxyethanimidamide
Molecular FormulaC8H9FN2O
Molecular Weight168.17
XLogP1.1
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity172
SMILES
C1=CC=C(C(=C1)C/C(=N/O)/N)F
InChI
InChI=1S/C8H9FN2O/c9-7-4-2-1-3-6(7)5-8(10)11-12/h1-4,12H,5H2,(H2,10,11)
InChIKey
RBOFWRSUZSOXOE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2-fluorophenyl)-N'-hydroxyethanimidamide
CAS: 872361-89-2
CID: 24688411
Formula: C8H9FN2O
MW: 168.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight168.17
XLogP31.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass168.06989108
Monoisotopic Mass168.06989108
Topological Polar Surface Area58.6 Ų
Heavy Atom Count12
Formal Charge0
Complexity172
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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