1-(1-{[3-(trifluoromethyl)phenyl]methyl}-1H-1,2,3-triazol-4-yl)ethan-1-ol - ≥97% , CAS No.1443291-26-6

CAS: 1443291-26-6 Cat. No.: T1261977 Molecular Weight: 271.24 PubChem CID: 75176209
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Storage
Room temperature
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1mg
T1261977-1mg
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$296.90
5mg
T1261977-5mg
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$316.90
10mg
T1261977-10mg
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$354.90
500mg
T1261977-500mg
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$398.90
1g
T1261977-1g
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$506.90
5g
T1261977-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$1,525.90
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships 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

Specifications & Purity
≥97%
Storage
Room temperature
Purity
≥97%
Names and Identifiers
Canonical SmilesCC(C1=CN(N=N1)CC2=CC(=CC=C2)C(F)(F)F)O
IUPAC Name1-[1-[[3-(trifluoromethyl)phenyl]methyl]triazol-4-yl]ethanol
InChIKeyQEEYXYCETHMVIQ-UHFFFAOYSA-N
INCHI1S/C12H12F3N3O/c1-8(19)11-7-18(17-16-11)6-9-3-2-4-10(5-9)12(13,14)15/h2-5,7-8,19H,6H2,1H3
Isomeric SMILES CC(C1=CN(N=N1)CC2=CC(=CC=C2)C(F)(F)F)O
PubChem CID 75176209
Molecular Weight 271.24

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.

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🔬 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
SubclassTrifluoromethylbenzenes
Intermediate Tree Nodes Not available
Direct ParentTrifluoromethylbenzenes
Alternative Parents Triazoles  Heteroaromatic compounds  Secondary alcohols  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organofluorides  Hydrocarbon derivatives  Aromatic alcohols  Alkyl fluorides  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Trifluoromethylbenzene - Azole - 1,2,3-triazole - Heteroaromatic compound - Secondary alcohol - Organoheterocyclic compound - Azacycle - Alcohol - Hydrocarbon derivative - Aromatic alcohol - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
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 Weight271.240 g/mol
XLogP31.700
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass271.093 Da
Monoisotopic Mass271.093 Da
Topological Polar Surface Area50.900 Ų
Heavy Atom Count19
Formal Charge0
Complexity300.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
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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