trans-2,4-Difluorocinnamic acid - ≥98% , CAS No.94977-52-3

CAS: 94977-52-3 Cat. No.: T120761 分子式: C9H6F2O2 分子量: 184.14 Beilstein Registry Number: 9(4)2030 EC番号: 627-327-7 PubChem CID: 5374945
注文可能
GRADE & PURITY ≥98%
Synonyms
2-Propenoic acid, 3-(2,4-difluorophenyl)-, (2E)- | STK893728 | UNII-3Q2JP0VD8J | 4,4-DIFLUOROHEPTANEDIOICACIDDIETHYLESTER | trans-2,4-Difluorocinnamic acid, 97% | BBL021022 | AMY6605 | 2,4-Difluorocinnamic acid | 2,4-difluoro-cinnamic acid | SCHEMBL716629
Storage
Room temperature
Shipped In
Normal
★
Size
USA
ドイツ (EU)*
Price
Qty
1g
T120761-1g
6 在庫あり
—

$9.90

$14.90
保存 $5.00 (33.56%)
5g
T120761-5g
6 在庫あり
—

$13.90

$20.90
保存 $7.00 (33.49%)
25g
T120761-25g
4 在庫あり
—

$37.90

$56.90
保存 $19.00 (33.39%)
100g
T120761-100g
2 在庫あり
—

$121.90

$182.90
保存 $61.00 (33.35%)
Enter a quantity for the sizes you want to add.
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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.

概要

trans-2,4-Difluorocinnamic acid may be used in chemical synthesis.   

Specifications

同義語
2-Propenoic acid, 3-(2,4-difluorophenyl)-, (2E)- | STK893728 | UNII-3Q2JP0VD8J | 4,4-DIFLUOROHEPTANEDIOICACIDDIETHYLESTER | trans-2,4-Difluorocinnamic acid, 97% | BBL021022 | AMY6605 | 2,4-Difluorocinnamic acid | 2,4-difluoro-cinnamic acid | SCHEMBL716629
仕様と純度
≥98%
保管条件
Room temperature
入荷
Normal
純度
≥98%
名前と識別子
パブケム・シド488195507
パブケム・シド・ウルhttps://pubchem.ncbi.nlm.nih.gov/substance/488195507
カノニカル・スマイルC1=CC(=C(C=C1F)F)C=CC(=O)O
IUPAC Name(E)-3-(2,4-difluorophenyl)prop-2-enoic acid
InChIKeyPQDXPFJQTKGTFP-DUXPYHPUSA-N
INCHI1S/C9H6F2O2/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1-5H,(H,12,13)/b4-2+
異性体SMILES C1=CC(=C(C=C1F)F)/C=C/C(=O)O
WGKドイツ 3
PubChem CID 5374945
分子量 184.14
Beilstein 9(4)2030
Reaxy-Rn 9324441

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
SuperclassPhenylpropanoids and polyketides
分類Cinnamic acids and derivatives
SubclassCinnamic acids
Intermediate Tree Nodes Not available
Direct ParentCinnamic acids
Alternative Parents Styrenes  Fluorobenzenes  Aryl fluorides  Monocarboxylic acids and derivatives  Carboxylic acids  Organofluorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Cinnamic acid - Styrene - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Organohalogen compound - Organofluoride - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
説明This compound belongs to the class of organic compounds known as cinnamic acids. These are organic aromatic compounds containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.
External Descriptors Not available
3 D構造
インタラクティブ化学構造モデル





証明書(CoA、COO、BSE/TSEと分析図)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

13 results found

Lot NumberCertificate Type日付商品
L2216359Certificate of AnalysisSep 07, 2026 T120761
L2216360Certificate of AnalysisSep 07, 2026 T120761
L2216362Certificate of AnalysisSep 07, 2026 T120761
L2216363Certificate of AnalysisSep 07, 2026 T120761
L2216499Certificate of AnalysisSep 07, 2026 T120761
L2216516Certificate of AnalysisSep 07, 2026 T120761
L2216518Certificate of AnalysisSep 07, 2026 T120761
L2216522Certificate of AnalysisSep 07, 2026 T120761
B2225763Certificate of AnalysisDec 12, 2025 T120761
B2226178Certificate of AnalysisDec 12, 2025 T120761
B2226181Certificate of AnalysisDec 12, 2025 T120761
E1619016Certificate of AnalysisJan 22, 2024 T120761
B2225871Certificate of AnalysisFeb 12, 2022 T120761

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化学的性質と物理的性質
融点(°C)217°C
分子量184.140 g/mol
XLogP32.100
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass184.034 Da
Monoisotopic Mass184.034 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count13
Formal Charge0
Complexity216.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds1
Covalently-Bonded Unit Count1
ソリューション計算機
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