2-Methylnaphthalene-d10 - ≥97%(CP),≥98 atom% D, NMR , CAS No.7297-45-2

CAS: 7297-45-2 Cat. No.: M757235 Summenformel: C₁₁D₁₀ Molekulargewicht: 152.26 EG-Nummer: 690-167-1

GRADE & PURITY ≥97%(CP),≥98 atom% D, NMR

Synonyms

ß-Methylnaphthalene-d10 | 7-(Methyl-d3)naphthalene-1,2,3,4,5,6,8-d7 | 2-Methylnaphthalene D10

Storage

Store at 2-8°C

Shipped In

Wet ice

Übersicht

2-Methylnaphthalene-d10 is the deuterium labeled Methylnaphthalene.

Specifications

Synonyme

ß-Methylnaphthalene-d10 | 7-(Methyl-d3)naphthalene-1,2,3,4,5,6,8-d7 | 2-Methylnaphthalene D10

Spezifikationen & Reinheit

≥97%(CP),≥98 atom% D, NMR

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥97%(CP),≥98 atom% D

Namen und Kennungen

Pubchem Sid

528757390

Kanonisches Lächeln

CC1=CC2=CC=CC=C2C=C1

IUPAC Name

1,2,3,4,5,6,8-heptadeuterio-7-(trideuteriomethyl)naphthalene

InChIKey

QIMMUPPBPVKWKM-UZHHFJDZSA-N

INCHI

1S/C11H10/c1-9-6-7-10-4-2-3-5-11(10)8-9/h2-8H,1H3/i1D3,2D,3D,4D,5D,6D,7D,8D

Isomere SMILES

[2H]C1=C(C(=C2C(=C(C(=C(C2=C1[2H])[2H])[2H])C([2H])([2H])[2H])[2H])[2H])[2H]

Alternative CAS-Nummer

91-57-6（unlabelled）

Molekulargewicht

152.26

Reaxy-Rn

906859

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=906859&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Naphthalenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Naphthalenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthalenes
• Alternative Parents: Aromatic hydrocarbons Polycyclic hydrocarbons Unsaturated hydrocarbons
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homopolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
• 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

Chemische und physikalische Eigenschaften

• Siedepunkt (°C): 241-242 °C (lit.)
• Schmelzpunkt (°C): mp34-36 °C (lit.)
• Molekulargewicht: 152.260 g/mol
• XLogP3: 3.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 152.141 Da
• Monoisotopic Mass: 152.141 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 128.000
• Isotope Atom Count: 10
• 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