TB5 - ≥98% , CAS No.948841-07-4

CAS: 948841-07-4 Cat. No.: T413539 分子式: C15H14BrNOS 分子量: 336.25 PubChem CID: 101571768
注文可能
GRADE & PURITY ≥98%
Synonyms
2-​Propen-​1-​one,1-​(5-​bromo-​2-​thienyl)​-​3-​[4-​(dimethylamino)​phenyl]​-​,(2E)​-
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
★
Size
USA
ドイツ (EU)*
Price
Qty
5mg
T413539-5mg
3 在庫あり
—

$33.90

$50.90
保存 $17.00 (33.40%)
25mg
T413539-25mg
3 在庫あり
—

$123.90

$185.90
保存 $62.00 (33.35%)
100mg
T413539-100mg
2 在庫あり
—

$394.90

$592.90
保存 $198.00 (33.40%)
250mg
T413539-250mg
2 在庫あり
—

$670.90

$1,006.90
保存 $336.00 (33.37%)
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads 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.

概要

Information

TB5 is a potent and selectiveMAO-Binhibitor with Ki values of 110 and 1,450 nM for MAO-B and MAO-A, respectively.


Targets

MAO-B 110 nM(Ki)

Specifications

同義語
2-​Propen-​1-​one,1-​(5-​bromo-​2-​thienyl)​-​3-​[4-​(dimethylamino)​phenyl]​-​,(2E)​-
仕様と純度
≥98%
生化学的・生理学的メカニズム
TB5 is a potent and selective MAO-B inhibitor with Ki values of 110 and 1,450 nM for MAO-B and MAO-A, respectively.
保管条件
Store at -20°C
入荷
Ice chest + Ice pads
この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。
純度
≥98%
名前と識別子
パブケム・シド
パブケム・シド・ウル
https://pubchem.ncbi.nlm.nih.gov/substance/504772768
カノニカル・スマイル
CN(C)C1=CC=C(C=C1)C=CC(=O)C2=CC=C(S2)Br
IUPAC Name
(E)-1-(5-bromothiophen-2-yl)-3-[4-(dimethylamino)phenyl]prop-2-en-1-one
InChIKey
PTLDLBSWTKNYCY-VMPITWQZSA-N
INCHI
1S/C15H14BrNOS/c1-17(2)12-6-3-11(4-7-12)5-8-13(18)14-9-10-15(16)19-14/h3-10H,1-2H3/b8-5+
異性体SMILES
CN(C)C1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(S2)Br
PubChem CID
101571768
分子量
336.25

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
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentCinnamic acids and derivatives
Alternative Parents Styrenes  Dialkylarylamines  Aryl ketones  Aniline and substituted anilines  2,5-disubstituted thiophenes  Aryl bromides  Heteroaromatic compounds  Enones  Acryloyl compounds  Organobromides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Cinnamic acid or derivatives - Styrene - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Aryl ketone - 2,5-disubstituted thiophene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Enone - Heteroaromatic compound - Thiophene - Alpha,beta-unsaturated ketone - Ketone - Tertiary amine - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
説明This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) 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.

4 results found

Lot NumberCertificate Type日付商品
G2201606Certificate of AnalysisApr 03, 2025 T413539
G2201607Certificate of AnalysisApr 03, 2025 T413539
G2201608Certificate of AnalysisApr 03, 2025 T413539
G2201609Certificate of AnalysisApr 03, 2025 T413539
化学的性質と物理的性質
溶解度Solubility (25°C) In vitro DMSO: 67 mg/mL (199.25 mM); Ethanol: 2 mg/mL (5.94 mM); Water: Insoluble;
分子量336.200 g/mol
XLogP34.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass334.998 Da
Monoisotopic Mass334.998 Da
Topological Polar Surface Area48.600 Ų
Heavy Atom Count19
Formal Charge0
Complexity337.000
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
レビュー

顧客レビュー

よくある質問

What is the purity of this product?
This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.
How should this product be stored?
Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.
How is this product shipped?
This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.
What are the CAS number, molecular formula and molecular weight?
The CAS Number is 948841-07-4, the molecular formula is C15H14BrNOS, and the molecular weight is 336.25 g/mol. InChIKey PTLDLBSWTKNYCY-VMPITWQZSA-N.
What documentation is provided?
Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.

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