Dimethylamine-d6 Hydrochloride - ≥99 atom% D , CAS No.53170-19-7

CAS: 53170-19-7 Cat. No.: D137625 Peso molecular: 87.58 Número EC: 258-409-7

GRADE & PURITY ≥99 atom% D

Synonyms

53170-19-7|Di((2H3)methyl)ammonium chloride|Dimethylamine D6 Hydrochloride|DIMETHYL-D 6-AMINE HYDROCHLORIDE|Dimethyl-d6-amine hydrochloride|EINECS 258-409-7|Dimethylamine-d6 Hydrochloride|Dimethyl-d6 amine hydrochloride|1,1,1-trideuterio-N-(trideuteriomet

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

53170-19-7 | Di((2H3)methyl)ammonium chloride | Dimethylamine D6 Hydrochloride | DIMETHYL-D 6-AMINE HYDROCHLORIDE | Dimethyl-d6-amine hydrochloride | EINECS 258-409-7 | Dimethylamine-d6 Hydrochloride | Dimethyl-d6 amine hydrochloride | 1, 1, 1-trideuterio-N-(trideuteriomet

Especificaciones y pureza

≥99 atom% D

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥99 atom% D

Nombres e identificadores

• Pubchem Sid: 504766963
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504766963
• Sonrisas canónicas: CNC.Cl
• IUPAC Name: 1,1,1-trideuterio-N-(trideuteriomethyl)methanamine;hydrochloride
• InChIKey: IQDGSYLLQPDQDV-TXHXQZCNSA-N
• INCHI: 1S/C2H7N.ClH/c1-3-2;/h3H,1-2H3;1H/i1D3,2D3
• Isómeros SMILES: [2H]C([2H])([2H])NC([2H])([2H])[2H].Cl
• WGK Alemania: 3
• Peso molecular: 87.58
• Reaxy-Rn: 3589311
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3589311&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass Amines
        • Level5 Secondary amines
          • Level6 Dialkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Secondary amines
• Direct Parent: Dialkylamines
• Alternative Parents: Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Secondary aliphatic amine - Hydrocarbon derivative - Hydrochloride - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dialkylamines. These are organic compounds containing a dialkylamine group, characterized by two 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

Propiedades químicas y físicas

• Sensibilidad: Moisture sensitive
• Punto de fusión (°C): 170-173 °C
• Peso molecular: 87.580 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 87.0722 Da
• Monoisotopic Mass: 87.0722 Da
• Topological Polar Surface Area: 12.000 Ų
• Heavy Atom Count: 4
• Formal Charge: 0
• Complexity: 2.800
• Isotope Atom Count: 6
• 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

Referencias

1. Xingdan Wang, Zhenghu Min, Xiaoqiu Yang, Qiwei Zhang, Qi Zheng.  (2025)  Analysis of phosphorylation site occupancy of peptides based on a chemical derivatization method.  Analytical Methods,  17  (8): (1923-1929).  [PMID:39927441] [10.1039/D4AY02208D]

2. Lunfei Zou, Yao Wang, Xingdan Wang, Xiaoqiu Yang, Qiwei Zhang, Qi Zheng.  (2024)  Stable isotope labeling-based two-step derivatization strategy for analysis of Phosphopeptides.  Journal of Proteomics,      [PMID:38382841] [10.1016/j.jprot.2024.105128]