2,6-Diethylaniline-d₁₅ - ≥98 atom% D , CAS No.285132-89-0

CAS: 285132-89-0 Cat. No.: D471986 Formule: (C₂D₅)₂C₆D₃ND₂ Poids moléculaire: 164.33 Numéro CE: 693-196-8

GRADE & PURITY ≥98 atom% D

Synonyms

N,N,3,4,5-pentadeuterio-2,6-bis(1,1,2,2,2-pentadeuterioethyl)aniline | HY-W017455S | 2,6-Diethylaniline-d15, 98 atom % D | AKOS015912440 | D98384 | DTXSID90584006 | 2,6-Diethylaniline-d15 | 2,6-Bis[(~2~H_5_)ethyl](~2~H_5_)aniline | J-017111

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonymes

N,N,3,4,5-pentadeuterio-2,6-bis(1,1,2,2,2-pentadeuterioethyl)aniline | HY-W017455S | 2,6-Diethylaniline-d15, 98 atom % D | AKOS015912440 | D98384 | DTXSID90584006 | 2,6-Diethylaniline-d15 | 2,6-Bis[(~2~H_5_)ethyl](~2~H_5_)aniline | J-017111

Spécifications et pureté

≥98 atom% D

Conditions de stockage de stockage

Store at 2-8°C

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥98 atom% D

Noms et identifiants

• Sourires canoniques: CCC1=C(C(=CC=C1)CC)N
• IUPAC Name: N,N,3,4,5-pentadeuterio-2,6-bis(1,1,2,2,2-pentadeuterioethyl)aniline
• InChIKey: FOYHNROGBXVLLX-IFODOZFGSA-N
• INCHI: 1S/C10H15N/c1-3-8-6-5-7-9(4-2)10(8)11/h5-7H,3-4,11H2,1-2H3/i1D3,2D3,3D2,4D2,5D,6D,7D/hD2
• Isomères SMILES: [2H]C1=C(C(=C(C(=C1[2H])C([2H])([2H])C([2H])([2H])[2H])N([2H])[2H])C([2H])([2H])C([2H])([2H])[2H])[2H]
• Poids moléculaire: 164.33
• Reaxy-Rn: 1423626
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1423626&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Monocyclic benzene moiety - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
• 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

• Indice de réfraction: n20/D 1.545 (lit.)
• Point d'éclair (°F): 239.0 °F - closed cup
• Point d'éclair (°C): 115.00 °C - closed cup
• Point d'ébullition (°C): 243℃ (lit.)
• Poids moléculaire: 164.320 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 164.215 Da
• Monoisotopic Mass: 164.215 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 99.400
• Isotope Atom Count: 15
• 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

What is the isotopic enrichment of this product?

This product is isotopically enriched to ≥98 atom% deuterium. Isotopic enrichment is a separate specification from chemical purity — a labelled compound has both. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 285132-89-0, the molecular formula is C10H15N, and the molecular weight is 164.33 g/mol. InChIKey FOYHNROGBXVLLX-IFODOZFGSA-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.