CAS 52914-23-5 | 4-Iodophenethyl alcohol | CAS Number 52914-23-5

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52914-23-5 | 4-Iodophenethyl alcohol

CAS No: 52914-23-5 Catalog No: AG00DC13 MDL No:MFCD00173705

Product Description

Catalog Number:

AG00DC13

Chemical Name:

4-Iodophenethyl alcohol

CAS Number:

52914-23-5

Molecular Formula:

C8H9IO

Molecular Weight:

248.0609

MDL Number:

MFCD00173705

IUPAC Name:

2-(4-iodophenyl)ethanol

InChI:

InChI=1S/C8H9IO/c9-8-3-1-7(2-4-8)5-6-10/h1-4,10H,5-6H2

InChI Key:

GYUSTTSSRXDFKG-UHFFFAOYSA-N

SMILES:

OCCc1ccc(cc1)I

Properties

Complexity:

87.3

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

247.97g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

248.063g/mol

Monoisotopic Mass:

247.97g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

20.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1

Literature

Title	Journal
Bioconversion of iodoacetophenones by marine fungi.	Marine biotechnology (New York, N.Y.) 20120801
Monodispersed submicron porous silica particles functionalized with CD derivatives for chiral CEC.	Electrophoresis 20100101
Synthesis and application of mono-6-(3-methylimidazolium)-6-deoxyperphenylcarbamoyl-beta-cyclodextrin chloride as chiral stationary phases for high-performance liquid chromatography and supercritical fluid chromatography.	Journal of chromatography. A 20080222