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3-Iodo-1-propanol

CAT: 0024-sc-231755Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-231755Size:1 g
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CAS Number
627-32-7

Chemical Information

3-Iodo-1-propanol
CAS Number627-32-7
PubChem CID69390
IUPAC Name3-iodopropan-1-ol
Molecular FormulaC3H7IO
Molecular Weight185.99
XLogP1
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count5
Formal Charge0
Complexity16
SMILES
C(CO)CI
InChI
InChI=1S/C3H7IO/c4-2-1-3-5/h5H,1-3H2
InChIKey
CQVWOJSAGPFDQL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Iodo-1-propanol
CAS: 627-32-7
CID: 69390
Formula: C3H7IO
MW: 185.99
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight185.99
XLogP31
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass185.95416
Monoisotopic Mass185.95416
Topological Polar Surface Area20.2 Ų
Heavy Atom Count5
Formal Charge0
Complexity16.4
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