N,N-DIMETHYLDODECANAMIDE , CAS No.3007-53-2

CAS: 3007-53-2 Cat. No.: N169385 Formule: C₁₄H₂₉NO Poids moléculaire: 227.393 Numéro CE: 221-117-5

Synonyms

04BJ5OT1PA | n,n-dimethyl lauramide | SCHEMBL160049 | Q27247641 | N,N-Dimethyldodecanamide | N,N-Dimethyldodecamide | NSC 76600 | UNII-04BJ5OT1PA | MFCD00026554 | W-111715 | Lauric acid N,N-dimethylamide | DTXSID20880881 | Hallcomid M 12 | EC 221-117-5 |

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

04BJ5OT1PA | n,n-dimethyl lauramide | SCHEMBL160049 | Q27247641 | N,N-Dimethyldodecanamide | N,N-Dimethyldodecamide | NSC 76600 | UNII-04BJ5OT1PA | MFCD00026554 | W-111715 | Lauric acid N,N-dimethylamide | DTXSID20880881 | Hallcomid M 12 | EC 221-117-5 |

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Noms et identifiants

Sourires canoniques

CCCCCCCCCCCC(=O)N(C)C

IUPAC Name

N,N-dimethyldodecanamide

InChIKey

BDYUSDIJIDGWCY-UHFFFAOYSA-N

INCHI

1S/C14H29NO/c1-4-5-6-7-8-9-10-11-12-13-14(16)15(2)3/h4-13H2,1-3H3

Isomères SMILES

CCCCCCCCCCCC(=O)N(C)C

Poids moléculaire

227.393

Reaxy-Rn

1769950

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1769950&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Fatty Acyls
      • Subclass Fatty amides

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Fatty Acyls
• Subclass: Fatty amides
• Intermediate Tree Nodes: Not available
• Direct Parent: N-acyl amines
• Alternative Parents: Tertiary carboxylic acid amides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: N-acyl-amine - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as n-acyl amines. These are compounds containing a fatty acid moiety linked to an amine group through an ester linkage.
• 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

• Poids moléculaire: 227.390 g/mol
• XLogP3: 4.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 10
• Exact Mass: 227.225 Da
• Monoisotopic Mass: 227.225 Da
• Topological Polar Surface Area: 20.300 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 166.000
• 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

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 3007-53-2, the molecular formula is C14H29NO, and the molecular weight is 227.393 g/mol. InChIKey BDYUSDIJIDGWCY-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.