Phthalylsulfacetamide - ≥95% , CAS No.131-69-1

CAS: 131-69-1 Cat. No.: P498438 Fórmula: C16H14N2O6S Peso molecular: 362.36 Número CE: 205-035-7 PubChem CID: 8574
Disponível para encomenda
GRADE & PURITY ≥95%
Synonyms
CHEBI:135528 | HMS1613G10 | Pharmakon1600-01505728 | NSC 163977 | Oprea1_188425 | Phthalylsulfacetamide [BAN:NF] | Tamid | CCG-213977 | TSC-80 | Kalacet | SBI-0207072.P001 | 2-([(4-([Acetylamino]sulfonyl)phenyl)amino]carbonyl)benzoic acid | AB01563234_01
Storage
Room temperature
Shipped In
Normal
★
Size
Alemanha (EU)
USA*
Price
Qty
1g
P498438-1g
—
2 Em stock

10,33€

12,93€
Gravar 2,60 € (20.13%)
5g
P498438-5g
—
2 Em stock

29,42€

38,96€
Gravar 9,55 € (24.50%)
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

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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
CHEBI:135528 | HMS1613G10 | Pharmakon1600-01505728 | NSC 163977 | Oprea1_188425 | Phthalylsulfacetamide [BAN:NF] | Tamid | CCG-213977 | TSC-80 | Kalacet | SBI-0207072.P001 | 2-([(4-([Acetylamino]sulfonyl)phenyl)amino]carbonyl)benzoic acid | AB01563234_01
Especificações e pureza
≥95%
Condições de armazenamento de armazenamento
Room temperature
Enviado em
Normal
Pureza
≥95%
Nomes e identificadores
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504751704
Sorrisos canónicos
CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C(=O)O
IUPAC Name
2-[[4-(acetylsulfamoyl)phenyl]carbamoyl]benzoic acid
InChIKey
SNWQKAWITMVCQW-UHFFFAOYSA-N
INCHI
1S/C16H14N2O6S/c1-10(19)18-25(23,24)12-8-6-11(7-9-12)17-15(20)13-4-2-3-5-14(13)16(21)22/h2-9H,1H3,(H,17,20)(H,18,19)(H,21,22)
SMILES isoméricas
CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C(=O)O
PubChem CID
8574
Peso molecular
362.36

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
SuperclassBenzenoids
ClasseBenzene and substituted derivatives
SubclassAnilides
Intermediate Tree Nodes Aromatic anilides
Direct ParentBenzanilides
Alternative Parents Benzenesulfonamides  Benzamides  Benzenesulfonyl compounds  Benzoic acids  Benzoyl derivatives  Organosulfonic acids and derivatives  Acetamides  Aminosulfonyl compounds  Secondary carboxylic acid amides  Monocarboxylic acids and derivatives  Carboxylic acids  Hydrocarbon derivatives  Organopnictogen compounds  Organic oxides  Organonitrogen compounds  Carbonyl compounds  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Benzanilide - Benzenesulfonamide - Benzamide - Benzoic acid or derivatives - Benzoic acid - Benzenesulfonyl group - Benzoyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Acetamide - Carboxamide group - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as benzanilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with a benzene ring. They have the general structure RNC(=O)R', where R,R'= benzene.
External Descriptors Not available
Estrutura 3D
Modelo de Estrutura Química Interativa





Alvos associados (humanos)
ABCB11 Tchem Bile salt export pump (2311 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Alvos associados (não humanos)
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 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.

2 results found

Lot NumberCertificate TypeDataItem
C2317899Certificate of AnalysisMar 29, 2023 P498438
C2317939Certificate of AnalysisMar 29, 2023 P498438
Propriedades químicas e físicas
Peso molecular362.400 g/mol
XLogP31.000
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass362.057 Da
Monoisotopic Mass362.057 Da
Topological Polar Surface Area138.000 Ų
Heavy Atom Count25
Formal Charge0
Complexity619.000
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
Citations of This Product
Calculadoras de soluções
Revisões

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