5,5'''-Dihexyl-2,2':5',2'':5'',2'''-quaterthiophene - ≥98% , CAS No.132814-92-7

CAS: 132814-92-7 Cat. No.: D155889 Molecular Weight: 498.82
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
DTXSID201222342 | 5,5'''-Dihexyl-2,2' | alpha,omega-Dihexylquaterthiophene | D90337 | MFCD21396218 | 2-hexyl-5-[5-[5-(5-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene | SCHEMBL12622287 | D4842 | 5,5'''-Dihexyl-2,2':5',2'':5'',2'''-quaterthiophen
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
10mg
D155889-10mg
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$38.90

$58.90
Save $20.00 (33.96%)
25mg
D155889-25mg
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$84.90

$127.90
Save $43.00 (33.62%)
100mg
D155889-100mg
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$268.90

$403.90
Save $135.00 (33.42%)
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Why this grade

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

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

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

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Literature proof

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

Specifications

Synonyms
DTXSID201222342 | 5, 5'''-Dihexyl-2, 2' | alpha, omega-Dihexylquaterthiophene | D90337 | MFCD21396218 | 2-hexyl-5-[5-[5-(5-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene | SCHEMBL12622287 | D4842 | 5, 5'''-Dihexyl-2, 2':5', 2'':5'', 2'''-quaterthiophen
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Canonical SmilesCCCCCCC1=CC=C(S1)C2=CC=C(S2)C3=CC=C(S3)C4=CC=C(S4)CCCCCC
IUPAC Name2-hexyl-5-[5-[5-(5-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene
InChIKeyKGJQHEPGNCWZRN-UHFFFAOYSA-N
INCHI1S/C28H34S4/c1-3-5-7-9-11-21-13-15-23(29-21)25-17-19-27(31-25)28-20-18-26(32-28)24-16-14-22(30-24)12-10-8-6-4-2/h13-20H,3-12H2,1-2H3
Isomeric SMILES CCCCCCC1=CC=C(S1)C2=CC=C(S2)C3=CC=C(S3)C4=CC=C(S4)CCCCCC
Molecular Weight 498.82
Reaxy-Rn 8083208
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8083208&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
SuperclassOrganoheterocyclic compounds
ClassBi- and oligothiophenes
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentBi- and oligothiophenes
Alternative Parents 2,5-disubstituted thiophenes  Heteroaromatic compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Bithiophene - 2,5-disubstituted thiophene - Heteroaromatic compound - Thiophene - Hydrocarbon derivative - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as bi- and oligothiophenes. These are organic compounds containing two or more linked thiophene rings. Thiophene is a five-member aromatic ring with one sulfur and four carbon atoms.
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:
Chemical and Physical Properties
Melt Point(°C)178-182°C
Molecular Weight498.800 g/mol
XLogP311.400
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count13
Exact Mass498.154 Da
Monoisotopic Mass498.154 Da
Topological Polar Surface Area113.000 Ų
Heavy Atom Count32
Formal Charge0
Complexity480.000
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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