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2- (Cyclohexyloxy) -4-iodopyridine

CAT: 0127-OR1099165-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1099165-01Size:250 mg
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CAS Number
1430753-00-6
MDL Number
MFCD35176066
Purity
97%
Smiles
O (c1cc (I) ccn1) C1CCCCC1

Chemical Information

2-(Cyclohexyloxy)-4-iodopyridine
CAS Number1430753-00-6
PubChem CID89498049
IUPAC Name2-cyclohexyloxy-4-iodopyridine
Molecular FormulaC11H14INO
Molecular Weight303.14
XLogP3.6
Topological Polar Surface Area22.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity171
SMILES
C1CCC(CC1)OC2=NC=CC(=C2)I
InChI
InChI=1S/C11H14INO/c12-9-6-7-13-11(8-9)14-10-4-2-1-3-5-10/h6-8,10H,1-5H2
InChIKey
VJUHYRPUTVPPGR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Cyclohexyloxy)-4-iodopyridine
CAS: 1430753-00-6
CID: 89498049
Formula: C11H14INO
MW: 303.14
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight303.14
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass303.01201
Monoisotopic Mass303.01201
Topological Polar Surface Area22.1 Ų
Heavy Atom Count14
Formal Charge0
Complexity171
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