Dodecylamine（DDA） - ≥98% , CAS No.124-22-1

CAS: 124-22-1 Cat. No.: D113938 Formula: C₁₂H₂₇N Molecular Weight: 185.35 Beilstein Registry Number: 1633576 EC Number: 204-690-6

GRADE & PURITY ≥98%

Synonyms

n-Laurylamine | 1-Dodecylamine | CHEBI:193593 | Armeen 12D | Dodecylamine, puriss., >=99.5% (GC) | Dodecyl amine | Nissan amine BB | 1-Aminododecane | DTXCID901984 | HSDB 2645 | Q21091987 | Laurylamine | Dodecylamine

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyms

n-Laurylamine | 1-Dodecylamine | CHEBI:193593 | Armeen 12D | Dodecylamine, puriss., >=99.5% (GC) | Dodecyl amine | Nissan amine BB | 1-Aminododecane | DTXCID901984 | HSDB 2645 | Q21091987 | Laurylamine | Dodecylamine

Specifications & Purity

≥98%

Storage

Room temperature,Argon charged

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 508812561
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/508812561
• Canonical Smiles: CCCCCCCCCCCCN
• IUPAC Name: dodecan-1-amine
• InChIKey: JRBPAEWTRLWTQC-UHFFFAOYSA-N
• INCHI: 1S/C12H27N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-13H2,1H3
• Isomeric SMILES: CCCCCCCCCCCCN
• WGK Germany: 2
• RTECS: JR6475000
• UN Number: 2735
• Packing Group: I
• Molecular Weight: 185.35
• Beilstein: 1633576
• Reaxy-Rn: 1633576
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1633576&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Amines
        • Level5 Primary amines
          • Level6 Monoalkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Primary amines
• Direct Parent: Monoalkylamines
• Alternative Parents: Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organopnictogen compound - Hydrocarbon derivative - Primary aliphatic amine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic amine 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

Associated Targets(Human)

EPHX1 Tchem Epoxide hydrolase 1 (644 Activities)

Discover Target: EPHX1

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

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in water (78 mg/L 25°C); easily soluble in benzene, chloroform, ethanol, ether
• Sensitivity: air sensitive
• Freezing Point(°C): 26 °C
• Flash Point(°C): 115°C
• Boil Point(°C): 247-249 °C
• Melt Point(°C): 26 °C
• Molecular Weight: 185.350 g/mol
• XLogP3: 5.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 10
• Exact Mass: 185.214 Da
• Monoisotopic Mass: 185.214 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 81.200
• 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