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(2-Iodophenyl) methanol

CAT: 0013-GTR19246027-03Size: 10 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19246027-03Size:10 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
(2-Iodophenyl) methanol is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
CAS Number
5159-41-1
Smiles
OCC1=CC=CC=C1I
Molecular Formula
C7H7IO
Molecular Weight
234.0344
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Iodobenzylic alcohol
CAS Number5159-41-1
PubChem CID107629
IUPAC Name(2-iodophenyl)methanol
Molecular FormulaC7H7IO
Molecular Weight234.03
XLogP2
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity85
SMILES
C1=CC=C(C(=C1)CO)I
InChI
InChI=1S/C7H7IO/c8-7-4-2-1-3-6(7)5-9/h1-4,9H,5H2
InChIKey
WZCXOBMFBKSSFA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Iodobenzylic alcohol
CAS: 5159-41-1
CID: 107629
Formula: C7H7IO
MW: 234.03
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight234.03
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass233.95416
Monoisotopic Mass233.95416
Topological Polar Surface Area20.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity85
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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