Dodecylamine Acetate - ≥98%(T) , CAS No.2016-56-0

CAS: 2016-56-0 Cat. No.: D154685 Formule: C₁₂H₂₇N·C₂H₄O₂ Poids moléculaire: 245.41 Beilstein Registry Number: 4(4)797 Numéro CE: 217-956-1

GRADE & PURITY ≥98%(T)

Synonyms

DODECYLAMINEACETATE | D0981 | NSC97256 | NSC-97256 | 1-DODECANAMINE, ACETATE | Nopcogen 16L | 1-Dodecanamine acetate | AKOS015842068 | AS-59790 | W-109741 | Aminododecane Acetate | Dodecylammonium acetate | FT-0625580 | Acetic acid, dodecylamine salt | 1-

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

DODECYLAMINEACETATE | D0981 | NSC97256 | NSC-97256 | 1-DODECANAMINE, ACETATE | Nopcogen 16L | 1-Dodecanamine acetate | AKOS015842068 | AS-59790 | W-109741 | Aminododecane Acetate | Dodecylammonium acetate | FT-0625580 | Acetic acid, dodecylamine salt | 1-

Spécifications et pureté

≥98%(T)

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥98%(T)

Noms et identifiants

Pubchem Sid

504758204

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504758204

Sourires canoniques

CCCCCCCCCCCCN.CC(=O)O

IUPAC Name

acetic acid;dodecan-1-amine

InChIKey

HBRNMIYLJIXXEE-UHFFFAOYSA-N

INCHI

1S/C12H27N.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13;1-2(3)4/h2-13H2,1H3;1H3,(H,3,4)

Isomères SMILES

CCCCCCCCCCCCN.CC(=O)O

RTECS

JR6490000

Poids moléculaire

245.41

Beilstein

4(4)797

Reaxy-Rn

3704449

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3704449&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Carboxylic acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acids
• Intermediate Tree Nodes: Not available
• Direct Parent: Carboxylic acids
• Alternative Parents: Monocarboxylic acids and derivatives Organopnictogen compounds Organic salts Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Not available
• Substituents: Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as carboxylic acids. These are compounds containing a carboxylic acid group with the formula -C(=O)OH.
• 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

Propriétés chimiques et physiques

• Solubilité: Soluble in water
• Point de fusion (°C): 69 °C
• Poids moléculaire: 245.400 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 10
• Exact Mass: 245.235 Da
• Monoisotopic Mass: 245.235 Da
• Topological Polar Surface Area: 63.300 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 112.000
• 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

Foire aux questions

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 2016-56-0, the molecular formula is C12H27N·C2H4O2, and the molecular weight is 245.41 g/mol. InChIKey HBRNMIYLJIXXEE-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.