N-(2,6-Dichlorophenyl)thiourea - ≥95% , CAS No.6590-91-6

CAS: 6590-91-6 Cat. No.: N300449 Molecular Weight: 221.11 EC Number: 642-326-1
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Synonyms
AI3-63140 | AKOS005203003 | 2,6-dichlorophenyl thiourea | NCGC00246707-01 | PS-3403 | HMS2782D11 | (2,6-dichlorophenyl)thiourea | (2,6-dichlorophenyl)-thiourea | SMR000461638 | KUQHRGMPBWZVQR-UHFFFAOYSA-N | SCHEMBL3264509 | 1-(2,6-Dichlorophenyl)-2-thiour
Storage
Store at -20°C,Argon charged
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
N300449-1g
7

$9.90

$14.90
Save $5.00 (33.56%)
5g
N300449-5g
6

$29.90

$44.90
Save $15.00 (33.41%)
25g
N300449-25g
2

$132.90

$199.90
Save $67.00 (33.52%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

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

🌡

Storage & shipping

Store at -20°C,Argon charged Ships Ice chest + Ice pads 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

Synonyms
AI3-63140 | AKOS005203003 | 2, 6-dichlorophenyl thiourea | NCGC00246707-01 | PS-3403 | HMS2782D11 | (2, 6-dichlorophenyl)thiourea | (2, 6-dichlorophenyl)-thiourea | SMR000461638 | KUQHRGMPBWZVQR-UHFFFAOYSA-N | SCHEMBL3264509 | 1-(2, 6-Dichlorophenyl)-2-thiour
Specifications & Purity
≥95%
Storage
Store at -20°C, Argon charged
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥95%
Names and Identifiers
Pubchem Sid488191254
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488191254
Canonical SmilesC1=CC(=C(C(=C1)Cl)NC(=S)N)Cl
IUPAC Name(2,6-dichlorophenyl)thiourea
InChIKeyKUQHRGMPBWZVQR-UHFFFAOYSA-N
INCHI1S/C7H6Cl2N2S/c8-4-2-1-3-5(9)6(4)11-7(10)12/h1-3H,(H3,10,11,12)
Isomeric SMILES C1=CC(=C(C(=C1)Cl)NC(=S)N)Cl
Molecular Weight 221.11
Reaxy-Rn 2212144
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2212144&ln=

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
ClassBenzene and substituted derivatives
SubclassN-phenylthioureas
Intermediate Tree Nodes Not available
Direct ParentN-phenylthioureas
Alternative Parents Dichlorobenzenes  Aryl chlorides  Thioureas  Organopnictogen compounds  Organonitrogen compounds  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents N-phenylthiourea - 1,3-dichlorobenzene - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Thiourea - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as n-phenylthioureas. These are compounds containing a N-phenylthiourea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a thiourea group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(non-human)
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Large T antigen (1457 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
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.

6 results found

Lot NumberCertificate TypeDateItem
G23131177Certificate of AnalysisApr 07, 2026 N300449
G23131184Certificate of AnalysisApr 07, 2026 N300449
G23131185Certificate of AnalysisApr 07, 2026 N300449
G23131189Certificate of AnalysisApr 07, 2026 N300449
G23131197Certificate of AnalysisApr 07, 2026 N300449
G23131363Certificate of AnalysisApr 07, 2026 N300449
Chemical and Physical Properties
Melt Point(°C)155-159℃
Molecular Weight221.110 g/mol
XLogP31.300
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass219.963 Da
Monoisotopic Mass219.963 Da
Topological Polar Surface Area70.100 Ų
Heavy Atom Count12
Formal Charge0
Complexity167.000
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
Reviews

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