5-(Trifluoromethyl)-4-((trimethylsilyl)ethynyl)-1H-pyrrolo[2,3-b]pyridine , CAS No.1261365-60-9

CAS: 1261365-60-9 Cat. No.: T166779 Molecular Weight: 282.34 PubChem CID: 50987485
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Synonyms
5-(Trifluoromethyl)-4-((trimethylsilyl)ethynyl)-1H-pyrrolo[2,3-b]pyridine | trimethyl-[2-[5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]ethynyl]silane | 5-(Trifluoromethyl)-4-[(trimethylsilyl)ethynyl]-1H-pyrrolo[2,3-b]pyridine | 5-(Trifluoromethyl)-4-
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
1g
T166779-1g
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$1,732.90
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Why this grade

for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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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
5-(Trifluoromethyl)-4-((trimethylsilyl)ethynyl)-1H-pyrrolo[2, 3-b]pyridine | trimethyl-[2-[5-(trifluoromethyl)-1H-pyrrolo[2, 3-b]pyridin-4-yl]ethynyl]silane | 5-(Trifluoromethyl)-4-[(trimethylsilyl)ethynyl]-1H-pyrrolo[2, 3-b]pyridine | 5-(Trifluoromethyl)-4-
Storage
Room temperature
Shipped In
Normal
Names and Identifiers
Canonical SmilesC[Si](C)(C)C#CC1=C2C=CNC2=NC=C1C(F)(F)F
IUPAC Nametrimethyl-[2-[5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]ethynyl]silane
InChIKeyNWYBHFXLBJIPMT-UHFFFAOYSA-N
INCHI1S/C13H13F3N2Si/c1-19(2,3)7-5-9-10-4-6-17-12(10)18-8-11(9)13(14,15)16/h4,6,8H,1-3H3,(H,17,18)
Isomeric SMILES C[Si](C)(C)C#CC1=C2C=CNC2=NC=C1C(F)(F)F
WGK Germany 3
PubChem CID 50987485
Molecular Weight 282.34

Documentation

📋 Safety Data Sheet (SDS)

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

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✅ Certificate of Analysis (COA)

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

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassPyrrolopyridines
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentPyrrolopyridines
Alternative Parents Pyridines and derivatives  Pyrroles  Heteroaromatic compounds  Trialkylsilanes  Organic metalloid salts  Azacyclic compounds  Organonitrogen compounds  Organofluorides  Hydrocarbon derivatives  Alkyl fluorides  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Pyrrolopyridine - Pyridine - Pyrrole - Heteroaromatic compound - Trialkylsilane - Azacycle - Organic metalloid salt - Alkylsilane - Alkyl fluoride - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Organic metalloid moeity - Organohalogen compound - Organosilicon compound - Alkyl halide - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as pyrrolopyridines. These are compounds containing a pyrrolopyridine moiety, which consists of a pyrrole ring fused to a pyridine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
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
Molecular Weight282.340 g/mol
XLogP3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass282.08 Da
Monoisotopic Mass282.08 Da
Topological Polar Surface Area28.700 Ų
Heavy Atom Count19
Formal Charge0
Complexity402.000
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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