Benzyltriethylammonium Hydroxide - 10% in Water , CAS No.1836-42-6

CAS: 1836-42-6 Cat. No.: B351321 Fórmula: C₁₃H₂₃NO Peso molecular: 209.33

GRADE & PURITY 10% in Water

Synonyms

BENZYLTRIETHYLAMMONIUM HYDROXIDE (10% IN WATER) | FKPSBYZGRQJIMO-UHFFFAOYSA-M | BENZYLTRIETHYLAMMONIUMHYDROXIDE | DTXSID60171447 | Ammonium, benzyltriethyl-, hydroxide | HY-W127634 | Benzenemethanaminium, N-N-N-triethyl-, hydroxide | benzyl(triethyl)azani

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifications

Sinónimos

BENZYLTRIETHYLAMMONIUM HYDROXIDE (10% IN WATER) | FKPSBYZGRQJIMO-UHFFFAOYSA-M | BENZYLTRIETHYLAMMONIUMHYDROXIDE | DTXSID60171447 | Ammonium, benzyltriethyl-, hydroxide | HY-W127634 | Benzenemethanaminium, N-N-N-triethyl-, hydroxide | benzyl(triethyl)azani

Especificações e pureza

10% in Water

Condições de armazenamento de armazenamento

Room temperature,Desiccated

Enviado em

Normal

Nomes e identificadores

Pubchem Sid

504754835

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504754835

Sorrisos canónicos

CC[N+](CC)(CC)CC1=CC=CC=C1.[OH-]

IUPAC Name

benzyl(triethyl)azanium;hydroxide

InChIKey

FKPSBYZGRQJIMO-UHFFFAOYSA-M

INCHI

1S/C13H22N.H2O/c1-4-14(5-2,6-3)12-13-10-8-7-9-11-13;/h7-11H,4-6,12H2,1-3H3;1H2/q+1;/p-1

SMILES isoméricas

CC[N+](CC)(CC)CC1=CC=CC=C1.[OH-]

Peso molecular

209.33

Reaxy-Rn

3737942

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3737942&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Phenylmethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylmethylamines
• Alternative Parents: Benzylamines Aralkylamines Tetraalkylammonium salts Organopnictogen compounds Organic salts Organic oxoanionic compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylmethylamine - Benzylamine - Aralkylamine - Tetraalkylammonium salt - Quaternary ammonium salt - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Organic hydroxide - Amine - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
• 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: 209.330 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 209.178 Da
• Monoisotopic Mass: 209.178 Da
• Topological Polar Surface Area: 1.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 135.000
• 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: 2

XLogP3

Perguntas frequentes

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1836-42-6, the molecular formula is C13H23NO, and the molecular weight is 209.33 g/mol. InChIKey FKPSBYZGRQJIMO-UHFFFAOYSA-M.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.