3-dimethylaminopropionic acid - ≥95% , CAS No.6300-04-5

CAS: 6300-04-5 Cat. No.: D479274 Formula: C₅H₁₁NO₂ Peso molecolare: 117.15 Numero EC: 641-109-9

GRADE & PURITY ≥95%

Synonyms

3-(N,N-dimethylamino)propanoic acid | MFCD00482234 | 3-(N,N-Dimethylamino)propionic acid | DTXSID40286407 | AKOS005169842 | 3-dimethylaminopropionic acid, AldrichCPR | N,N-dimethyl-beta-alanine | NSC73153 | NSC-73153 | T1501 | 3-(dimethylamino)propanoic a

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Sinonimi

3-(N,N-dimethylamino)propanoic acid | MFCD00482234 | 3-(N,N-Dimethylamino)propionic acid | DTXSID40286407 | AKOS005169842 | 3-dimethylaminopropionic acid, AldrichCPR | N,N-dimethyl-beta-alanine | NSC73153 | NSC-73153 | T1501 | 3-(dimethylamino)propanoic a

Specifiche e purezza

≥95%

Condizioni di conservazione di stoccaggio

Store at -20°C

Spedito in

Ice chest + Ice pads

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥95%

Nomi e identificatori

• Pubchem Sid: 528758384
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/528758384
• Sorrisi canonici: CN(C)CCC(=O)O
• IUPAC Name: 3-(dimethylamino)propanoic acid
• InChIKey: JMOXSQYGVIXBBZ-UHFFFAOYSA-N
• INCHI: 1S/C5H11NO2/c1-6(2)4-3-5(7)8/h3-4H2,1-2H3,(H,7,8)
• Isomeri SMILES: CN(C)CCC(=O)O
• Peso molecolare: 117.15
• Reaxy-Rn: 1700763
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1700763&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: Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Amino acid - Tertiary aliphatic amine - Amino acid or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - 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

Proprietà chimiche e fisiche

• Punto di infiammabilità (°F): Not applicable
• Punto di infiammabilità (°C): Not applicable
• Punto di fusione (°C): 143 - 146 °C
• Peso molecolare: 117.150 g/mol
• XLogP3: -2.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 117.079 Da
• Monoisotopic Mass: 117.079 Da
• Topological Polar Surface Area: 40.500 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 80.500
• 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