Taxonomic Classification

Taxonomy Tree

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Clase	Diazines
Subclass	Pyrazines
Intermediate Tree Nodes	Not available
Direct Parent	Methoxypyrazines
Alternative Parents	Alkyl aryl ethers Metal aryls Heteroaromatic compounds Trialkyltins Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Methoxypyrazine - Alkyl aryl ether - Metal aryl - Heteroaromatic compound - Trialkyltin - Ether - Azacycle - Organic nitrogen compound - Organotin compound - Organooxygen compound - Organonitrogen compound - Organometallic compound - Organic post-transition metal moeity - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteromonocyclic compound
Descripción	This compound belongs to the class of organic compounds known as methoxypyrazines. These are pyrazines containing a methoxyl group attached to the pyrazine ring.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Estructura 3D

Certificados (CoA, COO, BSE/TSE y tabla de análisis)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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1 results found

Lot Number	Certificate Type	Fecha	Articulo
F2002153	Certificate of Analysis	Mar 08, 2024	T165914

Propiedades químicas y físicas

Punto de inflamación (°F)	>230 °F
Punto de inflamación (°C)	>110 °C
Peso molecular	399.200 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	11
Exact Mass	400.154 Da
Monoisotopic Mass	400.154 Da
Topological Polar Surface Area	35.000 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	241.000
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	1

Calculadoras de soluciones

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Reseñas

Sonrisas canónicas	CCCC[Sn](CCCC)(CCCC)C1=NC(=CN=C1)OC
IUPAC Name	tributyl-(6-methoxypyrazin-2-yl)stannane
InChIKey	WWRXJELRWGUPKZ-UHFFFAOYSA-N
INCHI	1S/C5H5N2O.3C4H9.Sn/c1-8-5-4-6-2-3-7-5;31-3-4-2;/h2,4H,1H3;31,3-4H2,2H3;
Isómeros SMILES	CCCC[Sn](CCCC)(CCCC)C1=NC(=CN=C1)OC
WGK Alemania	3
PubChem CID	16427103
Peso molecular	399.16

2-Methoxy-6-(tri-n-butylstannyl)pyrazine - ≥95% , CAS No.1105511-66-7

Specifications