Toladryl - ≥98% , CAS No.19804-27-4

CAS: 19804-27-4 Cat. No.: T346624 Fórmula: C₁₈H₂₃NO Peso molecular: 269.38 PubChem CID: 19935

GRAU & PUREZA ≥98%

Synonyms

ORPHENADRINE IMPURITY F | p-Methylbenzhydryl 2-Dimethylaminoethyl Ether | Diphenhydramine Impurity B | ETHYLAMINE, N,N-DIMETHYL-2-((P-METHYL-.ALPHA.-PHENYLBENZYL)OXY)- | P9633413CU | ORPHENADRINE CITRATE IMPURITY F [EP IMPURITY] | Ethanamine, N,N-dimethyl

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Especificações

Sinónimos

ORPHENADRINE IMPURITY F | p-Methylbenzhydryl 2-Dimethylaminoethyl Ether | Diphenhydramine Impurity B | ETHYLAMINE, N,N-DIMETHYL-2-((P-METHYL-.ALPHA.-PHENYLBENZYL)OXY)- | P9633413CU | ORPHENADRINE CITRATE IMPURITY F [EP IMPURITY] | Ethanamine, N,N-dimethyl

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Store at 2-8°C,Argon charged

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

504752950

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752950

Sorrisos canónicos

CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCCN(C)C

IUPAC Name

N,N-dimethyl-2-[(4-methylphenyl)-phenylmethoxy]ethanamine

InChIKey

PJUYQWIDNIAHIZ-UHFFFAOYSA-N

INCHI

1S/C18H23NO/c1-15-9-11-17(12-10-15)18(20-14-13-19(2)3)16-7-5-4-6-8-16/h4-12,18H,13-14H2,1-3H3

SMILES isoméricas

CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCCN(C)C

PubChem CID

19935

Peso molecular

269.38

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Diphenylmethanes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Diphenylmethanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylmethanes
• Alternative Parents: Benzylethers Toluenes Trialkylamines Dialkyl ethers Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylmethane - Benzylether - Toluene - Tertiary aliphatic amine - Tertiary amine - Ether - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl 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.

DOI: 10.1186/s13321-016-0174-y

Propriedades químicas e físicas

• Peso molecular: 269.400 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 269.178 Da
• Monoisotopic Mass: 269.178 Da
• Topological Polar Surface Area: 12.500 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 252.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1