4-iodobenzene-1-thiol - ≥95% , CAS No.52928-01-5

CAS: 52928-01-5 Cat. No.: I770506 Molecular Weight: 236.07 EC Number: 821-453-8
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Storage
Store at 2-8°C,Protected from light,Argon charged
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
25mg
I770506-25mg
1

$171.90

$299.90
Save $128.00 (42.68%)
100mg
I770506-100mg
2

$457.90

$693.90
Save $236.00 (34.01%)
250mg
I770506-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$942.90

$1,386.90
Save $444.00 (32.01%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Protected from light,Argon charged Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Specifications & Purity
≥95%
Storage
Store at 2-8°C, Protected from light, Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥95%
Names and Identifiers
Canonical SmilesC1=CC(=CC=C1S)I
InChIKeyIKZUTVQEBGHQJA-UHFFFAOYSA-N
INCHI1S/C6H5IS/c7-5-1-3-6(8)4-2-5/h1-4,8H
Isomeric SMILES C1=CC(=CC=C1S)I
Molecular Weight 236.07

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassThiophenols
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentThiophenols
Alternative Parents Iodobenzenes  Aryl iodides  Thiols  Organoiodides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Thiophenol - Iodobenzene - Halobenzene - Monocyclic benzene moiety - Aryl iodide - Aryl halide - Arylthiol - Hydrocarbon derivative - Organosulfur compound - Organoiodide - Organohalogen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as thiophenols. These are compounds containing a thiophenol ring, which a phenol derivative obtained by replacing the oxygen atom from the hydroxyl group (attached to the benzene) by a sulfur atom.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

5 results found

Lot NumberCertificate TypeDateItem
E2528704Certificate of AnalysisMay 22, 2025 I770506
E2528705Certificate of AnalysisMay 22, 2025 I770506
E2528706Certificate of AnalysisMay 22, 2025 I770506
E2528707Certificate of AnalysisMay 22, 2025 I770506
E2528708Certificate of AnalysisMay 22, 2025 I770506
Chemical and Physical Properties
SensitivityLight sensitive
Boil Point(°C)252.1±23.0°C(Predicted)
Melt Point(°C)85 °C
Molecular Weight236.080 g/mol
XLogP33.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass235.916 Da
Monoisotopic Mass235.916 Da
Topological Polar Surface Area1.000 Ų
Heavy Atom Count8
Formal Charge0
Complexity66.900
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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