DASB - ≥95% , CAS No.627490-01-1

CAS: 627490-01-1 Cat. No.: B669100 Fórmula: C16H17N3S Peso molecular: 283.39
Disponível para encomenda
GRADE & PURITY ≥95%
Synonyms
DASB | Benzonitrile, 3-amino-4-((2-((dimethylamino)methyl)phenyl)thio)- | UNII-PP549Z0645 | 3-Amino-4-(2-dimethylaminomethyl-phenylsulfanyl)-benzonitrile | PP549Z0645 | 3-amino-4-[2-[(dimethylamino)methyl]phenyl]sulfanylbenzonitrile | DTXSID001027386 | BD
Storage
Store at 2-8°C,Protected from light,Argon charged
Shipped In
Wet ice
Size
Alemanha (EU)
USA*
Price
Qty
5mg
B669100-5mg
8 Em stock
399,07€
25mg
B669100-25mg
3 Em stock
980,46€
100mg
B669100-100mg
4 Em stock
2256,03€
Enter a quantity for the sizes you want to add.
🧪

Why this grade

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

🌡

Storage & shipping

Store at 2-8°C,Protected from light,Argon charged Ships Wet ice 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

Sinónimos
DASB | Benzonitrile, 3-amino-4-((2-((dimethylamino)methyl)phenyl)thio)- | UNII-PP549Z0645 | 3-Amino-4-(2-dimethylaminomethyl-phenylsulfanyl)-benzonitrile | PP549Z0645 | 3-amino-4-[2-[(dimethylamino)methyl]phenyl]sulfanylbenzonitrile | DTXSID001027386 | BD
Especificações e pureza
≥95%
Condições de armazenamento de armazenamento
Store at 2-8°C,Protected from light,Argon charged
Enviado em
Wet ice
Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.
Pureza
≥95%
Propriedades do produto
ALogP2.9
Nomes e identificadores
Pubchem Sid528764089
Sorrisos canónicosCN(C)CC1=CC=CC=C1SC2=C(C=C(C=C2)C#N)N
IUPAC Name3-amino-4-[2-[(dimethylamino)methyl]phenyl]sulfanylbenzonitrile
InChIKeyUVWLEPXXYOYDGR-UHFFFAOYSA-N
INCHI1S/C16H17N3S/c1-19(2)11-13-5-3-4-6-15(13)20-16-8-7-12(10-17)9-14(16)18/h3-9H,11,18H2,1-2H3
SMILES isoméricas CN(C)CC1=CC=CC=C1SC2=C(C=C(C=C2)C#N)N
Peso molecular 283.39
Reaxy-Rn 8699082
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8699082&ln=

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
SuperclassOrganosulfur compounds
ClasseThioethers
SubclassAryl thioethers
Intermediate Tree Nodes Not available
Direct ParentDiarylthioethers
Alternative Parents Thiophenol ethers  Phenylmethylamines  Benzylamines  Benzonitriles  Aniline and substituted anilines  Aralkylamines  Trialkylamines  Sulfenyl compounds  Nitriles  Primary amines  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Diarylthioether - Benzonitrile - Benzylamine - Aniline or substituted anilines - Phenylmethylamine - Thiophenol ether - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Tertiary amine - Tertiary aliphatic amine - Sulfenyl compound - Nitrile - Carbonitrile - Primary amine - Organonitrogen compound - Hydrocarbon derivative - Cyanide - Organic nitrogen compound - Amine - Aromatic homomonocyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as diarylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two aryl groups.
External Descriptors Not available
Estrutura 3D
Modelo de Estrutura Química Interativa





Alvos associados (humanos)
SLC6A4 Tclin Sodium-dependent serotonin transporter (3 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
SLC6A2 Tclin Norepinephrine transporter (10102 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SLC6A4 Tclin Serotonin transporter (12625 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SLC6A3 Tclin Dopamine transporter (10535 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de ação
Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
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.

3 results found

Lot NumberCertificate TypeDataItem
B2625393Certificate of AnalysisFeb 06, 2026 B669100
B2625394Certificate of AnalysisFeb 06, 2026 B669100
B2625395Certificate of AnalysisFeb 06, 2026 B669100
Propriedades químicas e físicas
Peso molecular283.400 g/mol
XLogP32.900
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass283.114 Da
Monoisotopic Mass283.114 Da
Topological Polar Surface Area78.400 Ų
Heavy Atom Count20
Formal Charge0
Complexity349.000
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
Calculadoras de soluções
Revisões

Avaliações dos Clientes

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