4-hydroxy-3-(trifluoromethoxy)benzaldehyde - ≥97% , CAS No.53104-95-3

CAS: 53104-95-3 Cat. No.: H635959 Molecular Weight: 206.12 EC Number: 642-552-0 PubChem CID: 7018050
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
SCHEMBL856737 | BBL103771 | DTXSID60426949 | CL9012 | SY023030 | A829402 | STL557581 | AKOS005257919 | 4-Hydroxy-3-(trifluoromethoxy)benzaldehyde | AC-30069 | AM84216 | FT-0647519 | 4-Hydroxy-3-trifluoromethoxybenzaldehyde | 4-hydroxy-3-(trifluoromethoxy)
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
H635959-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$75.90

$113.90
Save $38.00 (33.36%)
5g
H635959-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$301.90

$452.90
Save $151.00 (33.34%)
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Why this grade

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

🌡

Storage & shipping

Room temperature Ships Normal 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
SCHEMBL856737 | BBL103771 | DTXSID60426949 | CL9012 | SY023030 | A829402 | STL557581 | AKOS005257919 | 4-Hydroxy-3-(trifluoromethoxy)benzaldehyde | AC-30069 | AM84216 | FT-0647519 | 4-Hydroxy-3-trifluoromethoxybenzaldehyde | 4-hydroxy-3-(trifluoromethoxy)
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Canonical SmilesC1=CC(=C(C=C1C=O)OC(F)(F)F)O
IUPAC Name4-hydroxy-3-(trifluoromethoxy)benzaldehyde
InChIKeyGPJSLRQIOKFRFL-UHFFFAOYSA-N
INCHI1S/C8H5F3O3/c9-8(10,11)14-7-3-5(4-12)1-2-6(7)13/h1-4,13H
Isomeric SMILES C1=CC(=C(C=C1C=O)OC(F)(F)F)O
Alternate CAS 53104-95-3
PubChem CID 7018050
Molecular Weight 206.12

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
SuperclassOrganic oxygen compounds
ClassOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Aldehydes - Aryl-aldehydes - Benzaldehydes
Direct ParentHydroxybenzaldehydes
Alternative Parents Phenoxy compounds  Phenol ethers  Benzoyl derivatives  1-hydroxy-2-unsubstituted benzenoids  Trihalomethanes  Organofluorides  Organic oxides  Hydrocarbon derivatives  Alkyl fluorides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Hydroxybenzaldehyde - Phenoxy compound - Benzoyl - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Benzenoid - Monocyclic benzene moiety - Trihalomethane - Alkyl halide - Organic oxide - Organofluoride - Organohalogen compound - Alkyl fluoride - Hydrocarbon derivative - Halomethane - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as hydroxybenzaldehydes. These are organic aromatic compounds containing a benzene ring carrying an aldehyde group and a hydroxyl group.
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 Weight206.120 g/mol
XLogP32.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass206.019 Da
Monoisotopic Mass206.019 Da
Topological Polar Surface Area46.500 Ų
Heavy Atom Count14
Formal Charge0
Complexity204.000
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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