Thieno[3,2-b]thiophene-2-carbonitrile - ≥98% , CAS No.40985-58-8

CAS: 40985-58-8 Cat. No.: T162468 Molecular Weight: 165.23 EC Number: 808-215-9 PubChem CID: 55252708
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
DTXSID80716950 | Thieno[3,2-b]thiophene-2-carbonitrile | SCHEMBL120632 | Y10200 | T3221 | AKOS006284960 | DS-15826 | A873179 | MFCD08059461 | AMY19054 | SY041259 | 2-Cyanothieno[3,2-b]thiophene | C7H3NS2 | thieno[3,2-b]thiophene-5-carbonitrile
Storage
Store at 2-8°C,Protected from light
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
100mg
T162468-100mg
3
$36.90
250mg
T162468-250mg
5
$72.90
1g
T162468-1g
2
$191.90
5g
T162468-5g
1
$616.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Protected from light 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

Synonyms
DTXSID80716950 | Thieno[3, 2-b]thiophene-2-carbonitrile | SCHEMBL120632 | Y10200 | T3221 | AKOS006284960 | DS-15826 | A873179 | MFCD08059461 | AMY19054 | SY041259 | 2-Cyanothieno[3, 2-b]thiophene | C7H3NS2 | thieno[3, 2-b]thiophene-5-carbonitrile
Specifications & Purity
≥98%
Storage
Store at 2-8°C, Protected from light
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥98%
Names and Identifiers
Pubchem Sid488201724
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488201724
Canonical SmilesC1=CSC2=C1SC(=C2)C#N
IUPAC Namethieno[3,2-b]thiophene-5-carbonitrile
InChIKeyUPRBPGCXCNBTQH-UHFFFAOYSA-N
INCHI1S/C7H3NS2/c8-4-5-3-7-6(10-5)1-2-9-7/h1-3H
Isomeric SMILES C1=CSC2=C1SC(=C2)C#N
PubChem CID 55252708
Molecular Weight 165.23
Reaxy-Rn 1238244

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
SuperclassOrganoheterocyclic compounds
ClassThienothiophenes
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentThienothiophenes
Alternative Parents 2,3,5-trisubstituted thiophenes  Heteroaromatic compounds  Nitriles  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Thienothiophene - 2,3,5-trisubstituted thiophene - Heteroaromatic compound - Thiophene - Nitrile - Carbonitrile - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as thienothiophenes. These are organic compounds containing two thiophene rings fused to each other.
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.

8 results found

Lot NumberCertificate TypeDateItem
B2602077Certificate of AnalysisMar 02, 2026 T162468
F2520136Certificate of AnalysisSep 09, 2022 T162468
K2229594Certificate of AnalysisSep 09, 2022 T162468
K2229707Certificate of AnalysisSep 09, 2022 T162468
K2229717Certificate of AnalysisSep 09, 2022 T162468
K2229719Certificate of AnalysisSep 09, 2022 T162468
K2229817Certificate of AnalysisSep 09, 2022 T162468
K2229830Certificate of AnalysisSep 09, 2022 T162468
Chemical and Physical Properties
Sensitivitylight sensitive
Melt Point(°C)50 °C
Molecular Weight165.200 g/mol
XLogP32.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass164.971 Da
Monoisotopic Mass164.971 Da
Topological Polar Surface Area80.300 Ų
Heavy Atom Count10
Formal Charge0
Complexity183.000
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
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