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· · COA & SDS Disponibile per ogni prodotto · Spedizione lo stesso giorno su articoli in magazzino Madam , CAS No.M669066
Synonyms
MADAM|n,n-dimethyl-2-(2-amino-4-methylphenylthio)benzylamine|N,N-dimethyl-2(2-amino-4-methylphenylthio)benzylamine|2-(2-((dimethylamino)methyl)phenylthio)-5-methylaniline|2-(2-Dimethylaminomethylphenylsulfanyl)-5-methylphenylamine|2-(2-((dimethylamino)methyl)phenylthio)-5-methylbenzenamine|2-(2-Dimethylaminomethyl-phenylsulfanyl)-5-methyl-phenylamine|2-[2-[(dimethylamino)methyl]phenyl]sulfanyl-5-methylaniline
Specifiche Sinonimi
MADAM | n,n-dimethyl-2-(2-amino-4-methylphenylthio)benzylamine | N,N-dimethyl-2(2-amino-4-methylphenylthio)benzylamine | 2-(2-((dimethylamino)methyl)phenylthio)-5-methylaniline | 2-(2-Dimethylaminomethylphenylsulfanyl)-5-methylphenylamine | 2-(2-((dimethylamino)methyl)phenylthio)-5-methylbenzenamine | 2-(2-Dimethylaminomethyl-phenylsulfan Mostra altro
Condizioni di conservazione di stoccaggio
Room temperature
Proprietà del prodotto Nomi e identificatori Sorrisi canonici
CC1=CC(=C(C=C1)SC2=CC=CC=C2CN(C)C)N
IUPAC Name
2-[2-[(dimethylamino)methyl]phenyl]sulfanyl-5-methylaniline
InChIKey
UABIXNSHHIMZEP-UHFFFAOYSA-N
INCHI
1S/C16H20N2S/c1-12-8-9-16(14(17)10-12)19-15-7-5-4-6-13(15)11-18(2)3/h4-10H,11,17H2,1-3H3
Isomeri SMILES
CC1=CC(=C(C=C1)SC2=CC=CC=C2CN(C)C)N
Dati avanzati Taxonomic Classification Kingdom Organic compounds Superclass Organosulfur compounds Classe Thioethers Subclass Aryl thioethers Intermediate Tree Nodes Not available Direct Parent Diarylthioethers Alternative Parents Thiophenol ethers Phenylmethylamines Benzylamines Aniline and substituted anilines Aminotoluenes Aralkylamines Trialkylamines Sulfenyl compounds Primary amines Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Diarylthioether - Benzylamine - Aminotoluene - Aniline or substituted anilines - Phenylmethylamine - Thiophenol ether - Aralkylamine - Toluene - Monocyclic benzene moiety - Benzenoid - Tertiary amine - Tertiary aliphatic amine - Sulfenyl compound - Primary amine - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Aromatic homomonocyclic compound Descrizione This 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 Data sources 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.
Struttura 3D Obiettivi associati (umani) Obiettivi associati (non umani) Meccanismi d'azione Certificati (CoA, COO, BSE/TSE e tabella di analisi) Proprietà chimiche e fisiche Peso molecolare 272.400 g/mol XLogP3 3.500 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 4 Exact Mass 272.135 Da Monoisotopic Mass 272.135 Da Topological Polar Surface Area 54.600 Ų Heavy Atom Count 19 Formal Charge 0 Complexity 269.000 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
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