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Pyridine-iodine Chloride Complex

CAT: 0572-TRC-P998923-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-P998923-500MGSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
6443-90-9
Hazard Statement
No Data Available
Smiles
ClI.c1ccncc1
Molecular Formula
C5H5N.ClI
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Pyridine Iodine Monochloride
CAS Number6443-90-9
PubChem CID10220417
Molecular FormulaC5H5ClIN
Molecular Weight241.46
Topological Polar Surface Area12.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity32
SMILES
C1=CC=NC=C1.ClI
InChI
InChI=1S/C5H5N.ClI/c1-2-4-6-5-3-1;1-2/h1-5H;
InChIKey
SYWWBJKPSYWUBN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pyridine Iodine Monochloride
CAS: 6443-90-9
CID: 10220417
Formula: C5H5ClIN
MW: 241.46
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight241.46
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass240.91552
Monoisotopic Mass240.91552
Topological Polar Surface Area12.9 Ų
Heavy Atom Count8
Formal Charge0
Complexity32.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes