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2-Cyclopropyl-5-iodopyridine

CAT: 0926-IVD04541-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-IVD04541-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2383045-41-6
MDL Number
MFCD31727839
Smiles
C1CC1C2=NC=C (C=C2) I
Molecular Formula
C8H8IN
Molecular Weight
245.06 g/mol
Controlled
No

Chemical Information

2-Cyclopropyl-5-iodopyridine
CAS Number2383045-41-6
PubChem CID91162875
IUPAC Name2-cyclopropyl-5-iodopyridine
Molecular FormulaC8H8IN
Molecular Weight245.06
XLogP2.1
Topological Polar Surface Area12.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity122
SMILES
C1CC1C2=NC=C(C=C2)I
InChI
InChI=1S/C8H8IN/c9-7-3-4-8(10-5-7)6-1-2-6/h3-6H,1-2H2
InChIKey
UOKNOGWGWGTPES-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Cyclopropyl-5-iodopyridine
CAS: 2383045-41-6
CID: 91162875
Formula: C8H8IN
MW: 245.06
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight245.06
XLogP32.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass244.97015
Monoisotopic Mass244.97015
Topological Polar Surface Area12.9 Ų
Heavy Atom Count10
Formal Charge0
Complexity122
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