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3,5-Diiodo-4-hydroxybenzonitrile

CAT: 1459-CS-T-19372Size: 1 EachDry Ice: NoHazardous: No
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Description
3,5-Diiodo-4-hydroxybenzonitrile is listed under Pesticide Standards and is intended for analytical research, quality control and pharmaceutical reference standard applications. The product is supplied by Clearsynth under CAT No. CS-T-19372. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
1689-83-4
Synonyms
3,5-Diiodo-4-hydroxybenzonitrile
Molecular Formula
C 7 H 3 I 2 NO
Molecular Weight
370.91
Additionnal Information
3,5-Diiodo-4-hydroxybenzonitrile is supplied with detailed characterization data compliant with regulatory guideline. 3,5-Diiodo-4-hydroxybenzonitrile can be used for analytical method development, method validation (AMV), Quality Control (QC), ANDA-related analytical work, and commercial pharmaceutical research applications.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

Ioxynil

Ioxynil is a nitrile that is benzonitrile substituted by a hydroxy group at position 4 and iodo groups at positions 3 and 5. It has a role as a herbicide, a xenobiotic and an environmental contaminant. It is a nitrile and an iodophenol.

CAS Number1689-83-4
PubChem CID15530
IUPAC Name4-hydroxy-3,5-diiodobenzonitrile
Molecular FormulaC7H3I2NO
Molecular Weight370.91
XLogP2
Topological Polar Surface Area44
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity176
SMILES
C1=C(C=C(C(=C1I)O)I)C#N
InChI
InChI=1S/C7H3I2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H
InChIKey
NRXQIUSYPAHGNM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ioxynil
CAS: 1689-83-4
CID: 15530
Formula: C7H3I2NO
MW: 370.91
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight370.91
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass370.83041
Monoisotopic Mass370.83041
Topological Polar Surface Area44 Ų
Heavy Atom Count11
Formal Charge0
Complexity176
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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