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2- (2-Chlorophenoxy) -N'-hydroxyethanimidamide

CAT: 0127-OR1003334-02Size: 2.5 gDry Ice: NoHazardous: No
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CAT#:0127-OR1003334-02Size:2.5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
175276-80-9
MDL Number
MFCD00276991
Purity
95%
Smiles
NC(COc1ccccc1Cl)=NO

Chemical Information

2-(2-chlorophenoxy)-N'-hydroxyethanimidamide
CAS Number175276-80-9
PubChem CID9580824
IUPAC Name2-(2-chlorophenoxy)-N'-hydroxyethanimidamide
Molecular FormulaC8H9ClN2O2
Molecular Weight200.62
XLogP1.5
Topological Polar Surface Area67.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity187
SMILES
C1=CC=C(C(=C1)OC/C(=N/O)/N)Cl
InChI
InChI=1S/C8H9ClN2O2/c9-6-3-1-2-4-7(6)13-5-8(10)11-12/h1-4,12H,5H2,(H2,10,11)
InChIKey
NDOSJMHHYUKPIM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2-chlorophenoxy)-N'-hydroxyethanimidamide
CAS: 175276-80-9
CID: 9580824
Formula: C8H9ClN2O2
MW: 200.62
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight200.62
XLogP31.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass200.0352552
Monoisotopic Mass200.0352552
Topological Polar Surface Area67.8 Ų
Heavy Atom Count13
Formal Charge0
Complexity187
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