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3-Methoxy-5-(trifluoromethyl)cinnamic acid - ≥95% , CAS No.1092460-71-3

3-Methoxy-5-(trifluoromethyl)cinnamic acid - ≥95% , CAS No.1092460-71-3

Name: 3-Methoxy-5-(trifluoromethyl)cinnamic acid - ≥95% , CAS No.1092460-71-3
Brand: Aladdin Scientific
SKU: M958496
Availability: InStock

CAS: 1092460-71-3 Cat. No.: M958496 Molecular Weight: 246.18 PubChem CID: 60138048

COA

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AVAILABLE TO ORDER

GRADE & PURITY ≥95%

Storage

Room temperature

Specifications Names and Identifiers Documentation Advanced Data 3D Structure Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solution Calculators Reviews

🧪

Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships 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

Specifications & Purity

≥95%

Storage

Room temperature

Purity

≥95%

Names and Identifiers

Canonical Smiles	COC1=CC(=CC(=C1)C(F)(F)F)C=CC(=O)O
IUPAC Name	(E)-3-[3-methoxy-5-(trifluoromethyl)phenyl]prop-2-enoic acid
InChIKey	PHVYEXUYVALSAZ-NSCUHMNNSA-N
INCHI	1S/C11H9F3O3/c1-17-9-5-7(2-3-10(15)16)4-8(6-9)11(12,13)14/h2-6H,1H3,(H,15,16)/b3-2+
Isomeric SMILES	COC1=CC(=CC(=C1)C(F)(F)F)/C=C/C(=O)O
PubChem CID	60138048
Molecular Weight	246.18

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

3D Structure

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	246.180 g/mol
XLogP3	2.700
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	246.05 Da
Monoisotopic Mass	246.05 Da
Topological Polar Surface Area	46.500 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	299.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	1
Covalently-Bonded Unit Count	1

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