N,N-Dimethyldodecylamine - ≥96%(GC)(T) , CAS No.112-18-5

CAS: 112-18-5 Cat. No.: N159397 Formula: C₁₄H₃₁N Peso molecolare: 213.41 Beilstein Registry Number: 1700190 Numero EC: 203-943-8

GRADE & PURITY ≥96%(GC)(T)

Synonyms

DDA | AKOS005720939 | BBL011370 | Dimethyl-n-dodecylamine | 1,1-Dimethyl-aminododecane | ADMA 2 | NSC-7332 | DDA (antioxidant) | Genamin LA 302D | 6V2OM30I1Z | Barlene 125 | N,N-DIMETHYL-1-DODECANAMINE | N,N-dimethyldodecan-1-amine | dodecyldimethyl amine

Storage

Protected from light,Room temperature,Argon charged,Desiccated

Shipped In

Normal

Panoramica

It has been used: . as a capping agent during the synthesis of Au(core)-Pd(shell) bimetallic nanoparticles in toluene . in the synthesis of N-alkyl-N,N-dimethyl-1-ammonio-2-hydroxy-3-propane sulfonate . in the preparation of novel bis-quaternary ammonium salt, via reaction with epichlorohydrin (in the presence of the amine hydrochloride) or various dichloro compounds.

Specifications

Sinonimi

DDA | AKOS005720939 | BBL011370 | Dimethyl-n-dodecylamine | 1,1-Dimethyl-aminododecane | ADMA 2 | NSC-7332 | DDA (antioxidant) | Genamin LA 302D | 6V2OM30I1Z | Barlene 125 | N,N-DIMETHYL-1-DODECANAMINE | N,N-dimethyldodecan-1-amine | dodecyldimethyl amine

Specifiche e purezza

≥96%(GC)(T)

Condizioni di conservazione di stoccaggio

Protected from light,Room temperature,Argon charged,Desiccated

Spedito in

Normal

Purezza

≥96%(GC)(T)

Nomi e identificatori

Pubchem Sid

504751611

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504751611

Sorrisi canonici

CCCCCCCCCCCCN(C)C

IUPAC Name

N,N-dimethyldodecan-1-amine

InChIKey

YWFWDNVOPHGWMX-UHFFFAOYSA-N

INCHI

1S/C14H31N/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3/h4-14H2,1-3H3

Isomeri SMILES

CCCCCCCCCCCCN(C)C

WGK Germania

2

RTECS

JR6600000

Numero UN

2735

Gruppo di imballaggio

I

Peso molecolare

213.41

Beilstein

1700190

Reaxy-Rn

1700191

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1700191&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass Amines
        • Level5 Tertiary amines
          • Level6 Trialkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Tertiary amines
• Direct Parent: Trialkylamines
• Alternative Parents: Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tertiary aliphatic amine - Organopnictogen compound - Hydrocarbon derivative - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as trialkylamines. These are organic compounds containing a trialkylamine group, characterized by exactly three alkyl groups bonded to the amino nitrogen.
• 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

Obiettivi associati (umani)

ESR1 Tclin Estrogen receptor alpha (17718 Activities)

Discover Target: ESR1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

DNM1 Tbio Dynamin-1 (215 Activities)

Discover Target: DNM1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

NR1H4 Tclin Bile acid receptor FXR (6228 Activities)

Discover Target: NR1H4

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Obiettivi associati (non umani)

Staphylococcus aureus (210822 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Slightly soluble in water.
• Sensibilità: Moisture sensitive；Air sensitive
• Indice di rifrazione: 1.43
• Punto di infiammabilità (°F): 235.4 °F
• Punto di infiammabilità (°C): 113 °C
• Punto di ebollizione (°C): 149 ℃
• Punto di fusione (°C): -20 °C
• Peso molecolare: 213.400 g/mol
• XLogP3: 5.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 11
• Exact Mass: 213.246 Da
• Monoisotopic Mass: 213.246 Da
• Topological Polar Surface Area: 3.200 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 110.000
• 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

Domande frequenti

What is the purity of this product, and how is it determined?

This product is supplied at ≥96% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store in a cool place, protected from light, desiccated, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

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 112-18-5, the molecular formula is C14H31N, and the molecular weight is 213.41 g/mol. InChIKey YWFWDNVOPHGWMX-UHFFFAOYSA-N.

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.