N-Dodecilanilina - ≥93%(GC) , CAS No.3007-74-7

CAS: 3007-74-7 Cat. No.: N159431 Fórmula: C₁₈H₃₁N Peso molecular: 261.45 Beilstein Registry Number: 12(3)2776 Número CE: 221-118-0

GRADE & PURITY ≥93%(GC)

Synonyms

n-Dodecyl-N-phenylamine | D0987 | N-dodecylaminobenzene | Benzenamine, N-dodecyl- | D89754 | DODECYLANILINE, N- | n-Dodecyl-N-phenylamine # | N-N-Dodecylaniline | DTXSID1073311 | Q27255820 | 1-(2,5-DIMETHOXYBENZYL)PIPERAZINEHYDROCHLORIDE | MFCD00026570 |

Storage

Armazenar a 2-8°C, carregado com árgon

Shipped In

Gelo húmido

Specifications

Sinónimos

n-Dodecyl-N-phenylamine | D0987 | N-dodecylaminobenzene | Benzenamine, N-dodecyl- | D89754 | DODECYLANILINE, N- | n-Dodecyl-N-phenylamine # | N-N-Dodecylaniline | DTXSID1073311 | Q27255820 | 1-(2,5-DIMETHOXYBENZYL)PIPERAZINEHYDROCHLORIDE | MFCD00026570 |

Especificações e pureza

≥93%(GC)

Condições de armazenamento de armazenamento

Armazenar a 2-8°C, carregado com árgon

Enviado em

Gelo húmido

Pureza

≥93%(GC)

Nomes e identificadores

• Pubchem Sid: 504755052
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504755052
• Sorrisos canónicos: CCCCCCCCCCCCNC1=CC=CC=C1
• IUPAC Name: N-dodecylaniline
• InChIKey: LQKYCMRSWKQVBQ-UHFFFAOYSA-N
• INCHI: 1S/C18H31N/c1-2-3-4-5-6-7-8-9-10-14-17-19-18-15-12-11-13-16-18/h11-13,15-16,19H,2-10,14,17H2,1H3
• SMILES isoméricas: CCCCCCCCCCCCNC1=CC=CC=C1
• Peso molecular: 261.45
• Beilstein: 12(3)2776
• Reaxy-Rn: 2725280
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2725280&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass Amines
        • Level5 Aralkylamines
          • Level6 Phenylalkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Aralkylamines
• Direct Parent: Phenylalkylamines
• Alternative Parents: Aniline and substituted anilines Secondary alkylarylamines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Benzenoid - Monocyclic benzene moiety - Secondary amine - Organopnictogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as phenylalkylamines. These are organic amines where the amine group is secondary and linked on one end to a phenyl group and on the other end, to an alkyl group.
• 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

• Solubilidade: Soluble in Benzene
• Sensibilidade: Air Sensitive
• Ponto de fusão (°C): 25 °C
• Peso molecular: 261.399 g/mol
• XLogP3: 7.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 12
• Exact Mass: 261.246 Da
• Monoisotopic Mass: 261.246 Da
• Topological Polar Surface Area: 12.000 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 173.000
• 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

Referências

1. Lin Chen, Yunpeng Wang, Yifei Lang, Wen Wen, Zhongping Li, Huazhang Zhao, Yingfu Li, Nan Hu.  (2025)  Enhanced Removal of Sulfur-Containing Ions Post Persulfate Advanced Oxidation: Interfacial Adsorption-Mediated Foam Fractionation Process by Amphiphilic Graphene Oxide.  WATER RESEARCH,      [PMID:41242194] [10.1016/j.watres.2025.124923]

Perguntas frequentes

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

This product is supplied at ≥93% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 3007-74-7, the molecular formula is C18H31N, and the molecular weight is 261.45 g/mol. InChIKey LQKYCMRSWKQVBQ-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.