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5-Bromo-2-iodopyrimidine

CAT: 0063-67136936-25gSize: 25 gDry Ice: NoHazardous: No
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CAT#:0063-67136936-25gSize:25 g
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CAS Number
183438-24-6
Molecular Formula
C4H2BrIN2
Molecular Weight
284.88

Chemical Information

5-Bromo-2-iodopyrimidine
CAS Number183438-24-6
PubChem CID7006651
IUPAC Name5-bromo-2-iodopyrimidine
Molecular FormulaC4H2BrIN2
Molecular Weight284.88
XLogP1.6
Topological Polar Surface Area25.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity72
SMILES
C1=C(C=NC(=N1)I)Br
InChI
InChI=1S/C4H2BrIN2/c5-3-1-7-4(6)8-2-3/h1-2H
InChIKey
ZEZKXPQIDURFKA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Bromo-2-iodopyrimidine
CAS: 183438-24-6
CID: 7006651
Formula: C4H2BrIN2
MW: 284.88
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight284.88
XLogP31.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass283.84461
Monoisotopic Mass283.84461
Topological Polar Surface Area25.8 Ų
Heavy Atom Count8
Formal Charge0
Complexity72.4
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