N,N-Dimethylformamide-d₇ - ≥99.5 atom% D , CAS No.4472-41-7

CAS: 4472-41-7 Cat. No.: N102258 Formula: C₃D₇NO Peso molecolare: 80.14 Beilstein Registry Number: 1908468 Numero EC: 224-745-8

GRADE & PURITY ≥99.5 atom% D

Synonyms

DMF-d7 | Heptadeutero-N,N-dimethylformamide | 1-deuterio-N,N-bis(trideuteriomethyl)formamide | N,N-Dimethylformamide-d7, >=99.5 atom % D | Q1101322 | EINECS 224-745-8 | N,N-Dimethylformamide-d7 99.5atom%D | N,N-Dimethylformamide-d7 | AKOS015903050 | D3530

Storage

Room temperature,Argon charged

Shipped In

Normal

Panoramica

N,N-Dimethylformamide-d7 (DMF-d7) is a deuterated derivative of N,N-dimethylformamide. It has an isotopic purity of 99.5atom%D. It is a standard purity solvent suitable for routine NMR analyses (conducted at ambient temperatures where quality is less critical). It participates as a solvent to evaluate the solvation of 1.7molar solution of lithium chloride (LiCl) by pulsed neutron diffraction studies. Quadrupole splittings and quadrupole coupling constants of DMF-d7 oriented in a nematic phase have been evaluated by deuteron magnetic resonance studies. DMF-d7 is being considered as a potent anti-cancer drug.

Specifications

Sinonimi

DMF-d7 | Heptadeutero-N,N-dimethylformamide | 1-deuterio-N,N-bis(trideuteriomethyl)formamide | N,N-Dimethylformamide-d7, >=99.5 atom % D | Q1101322 | EINECS 224-745-8 | N,N-Dimethylformamide-d7 99.5atom%D | N,N-Dimethylformamide-d7 | AKOS015903050 | D3530

Specifiche e purezza

≥99.5 atom% D

Condizioni di conservazione di stoccaggio

Room temperature,Argon charged

Spedito in

Normal

Purezza

≥99.5 atom% D

Nomi e identificatori

• Pubchem Sid: 508813864
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/508813864
• Sorrisi canonici: CN(C)C=O
• IUPAC Name: 1-deuterio-N,N-bis(trideuteriomethyl)formamide
• InChIKey: ZMXDDKWLCZADIW-YYWVXINBSA-N
• INCHI: 1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3/i1D3,2D3,3D
• Isomeri SMILES: [2H]C(=O)N(C([2H])([2H])[2H])C([2H])([2H])[2H]
• WGK Germania: 3
• CAS alternativo: 68-12-2（unlabelled）
• Numero UN: 2265
• Peso molecolare: 80.14
• Beilstein: 1908468
• Reaxy-Rn: 605365
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=605365&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid amides
          • Level6 Tertiary carboxylic acid amides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid amides
• Direct Parent: Tertiary carboxylic acid amides
• Alternative Parents: Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tertiary carboxylic acid amide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as tertiary carboxylic acid amides. These are compounds containing an amide derivative of carboxylic acid, with the general structure RN(R1)C(R2)=O (R1-R2 any atom but H).
• 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

• Solubilità: Soluble in water.
• Sensibilità: Hygroscopic
• Indice di rifrazione: 1.428
• Punto di infiammabilità (°F): 136.4 °F
• Punto di infiammabilità (°C): 58°C
• Punto di ebollizione (°C): 153°C
• Peso molecolare: 80.140 g/mol
• XLogP3: -1.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 80.0967 Da
• Monoisotopic Mass: 80.0967 Da
• Topological Polar Surface Area: 20.300 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 33.900
• Isotope Atom Count: 7
• 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