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1-Iodohexadecane

CAT: 0024-sc-224712Size: 25 gDry Ice: NoHazardous: No
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CAT#:0024-sc-224712Size:25 g
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CAS Number
544-77-4

Chemical Information

1-Iodohexadecane

1-iodohexadecane has been reported in Vernonanthura patens with data available.

CAS Number544-77-4
PubChem CID11007
IUPAC Name1-iodohexadecane
Molecular FormulaC16H33I
Molecular Weight352.34
XLogP9.6
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count14
Heavy Atom Count17
Formal Charge0
Complexity123
SMILES
CCCCCCCCCCCCCCCCI
InChI
InChI=1S/C16H33I/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-16H2,1H3
InChIKey
KMWHQYDMBYABKL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Iodohexadecane
CAS: 544-77-4
CID: 11007
Formula: C16H33I
MW: 352.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight352.34
XLogP39.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count14
Exact Mass352.16270
Monoisotopic Mass352.16270
Topological Polar Surface Area0 Ų
Heavy Atom Count17
Formal Charge0
Complexity123
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

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