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(Pentylsulfanyl)methanimidamide hydrobromide , CAS No.4270-00-2
Disponible para pedir
Storage
Room temperature
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Why this grade
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
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores
| Sonrisas canónicas | CCCCCSC(=N)N.Br |
|---|---|
| IUPAC Name | pentyl carbamimidothioate;hydrobromide |
| InChIKey | JTEBEBGEFYAPTQ-UHFFFAOYSA-N |
| INCHI | 1S/C6H14N2S.BrH/c1-2-3-4-5-9-6(7)8;/h2-5H2,1H3,(H3,7,8);1H |
| Peso molecular | 227.17 |
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 →🔬 Specification Sheet
Full quality attributes and acceptance criteria for this grade.
View spec sheet →Advanced Data
Taxonomic Classification
Taxonomy Tree
- Kingdom Organic compounds
- Superclass Organosulfur compounds
- Clase Isothioureas
- Superclass Organosulfur compounds
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organosulfur compounds |
| Clase | Isothioureas |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Isothioureas |
| Alternative Parents | Sulfenyl compounds Carboximidamides Imines Hydrocarbon derivatives Hydrobromides |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Isothiourea - Sulfenyl compound - Carboximidamide - Organic nitrogen compound - Hydrocarbon derivative - Hydrobromide - Organonitrogen compound - Imine - Aliphatic acyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as isothioureas. These are organic compounds containing the isothiourea group, with the general structure R1SC(=NR2)N(R3)R4 (R1,R2,R3,R4=H, alkyl, aryl). |
| External Descriptors | Not available |
Estructura 3D
Modelo de Estructura Química Interactiva
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
| Peso molecular | 227.170 g/mol |
|---|---|
| XLogP3 | |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 226.014 Da |
| Monoisotopic Mass | 226.014 Da |
| Topological Polar Surface Area | 75.200 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 83.100 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 2 |
Calculadoras de soluciones
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