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116601-58-2

M-XYLENE-D10, a deuterated derivative of m-xylene, is characterized by an isotopic purity of 99 atom% D. M-XYLENE-D10 has been studied through pulsed beam Fourier transform microwave spectroscopy to evaluate its rotational spectra and rotational constants within a range of 6 and 26.5 GHz.
Usage:
M-XYLENE-D10 is used as a compound in various applications due to its unique properties and isotopic purity. The specific uses may vary across different industries, and some of the potential applications are as follows:
Used in Chemical Research:
M-XYLENE-D10 is used as a research compound for studying the effects of deuteration on the physical and chemical properties of m-xylene. Its application in this field aids in understanding the behavior of deuterated compounds and their potential benefits in various chemical reactions and processes.
Used in Spectroscopic Analysis:
M-XYLENE-D10 serves as a valuable tool in spectroscopic analysis, particularly in the study of rotational spectra. Its use in this context helps researchers to determine the rotational constants and gain insights into the structural and energetic properties of the molecule.
Used in Isotope Labeling:
In the field of isotope labeling, M-XYLENE-D10 is used as a labeled compound to track and monitor the behavior of molecules in chemical reactions, biological processes, and environmental studies. The deuterium labeling provides a distinct signature, allowing for easier detection and analysis of the labeled molecules.
Used in Pharmaceutical Development:
M-XYLENE-D10 may also find application in the pharmaceutical industry, where it can be used as an intermediate or a building block for the synthesis of deuterated drug molecules. These deuterated drugs may exhibit improved pharmacokinetic properties, such as enhanced stability, reduced metabolism, and increased bioavailability.

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  • 116601-58-2 Structure

  • Basic information

    1. Product Name: M-XYLENE-D10
    2. Synonyms: M-XYLENE-D10;M-XYLENE-D10 98.5%;1,3-dimethylbenzene-d10
    3. CAS NO:116601-58-2
    4. Molecular Formula: C8H10
    5. Molecular Weight: 116.23
    6. EINECS: N/A
    7. Product Categories: Additional NMR Solvents;Aldrich High Purity NMR Solvents for Routine NMR;Alphabetical Listings;High Throughput NMR;Labware;NMR;NMR Solvents;NMR Solvents and Reagents;Routine NMR;Solvent by Application;Solvents;Solvents for High Throughput NMR;Spectroscopy Solvents (IR;Stable Isotopes;Tubes and Accessories;UV/Vis);U-Z
    8. Mol File: 116601-58-2.mol

  • Chemical Properties

    1. Melting Point: −48 °C(lit.)
    2. Boiling Point: 138-139 °C(lit.)
    3. Flash Point: 77 °F
    4. Appearance: /
    5. Density: 0.95 g/mL at 25 °C(lit.)
    6. Vapor Pressure: 7.61mmHg at 25°C
    7. Refractive Index: n20/D 1.497(lit.)
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: M-XYLENE-D10(CAS DataBase Reference)
    11. NIST Chemistry Reference: M-XYLENE-D10(116601-58-2)
    12. EPA Substance Registry System: M-XYLENE-D10(116601-58-2)

  • Safety Data

    1. Hazard Codes: Xn
    2. Statements: 10-20/21/22-36/37/38-38-20/21
    3. Safety Statements: 16-26-36-25
    4. RIDADR: UN 1307 3/PG 3
    5. WGK Germany: 3
    6. RTECS:
    7. HazardClass: N/A
    8. PackingGroup: N/A
    9. Hazardous Substances Data: 116601-58-2(Hazardous Substances Data)

116601-58-2 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 116601-58-2 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,6,6,0 and 1 respectively; the second part has 2 digits, 5 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 116601-58:
(8*1)+(7*1)+(6*6)+(5*6)+(4*0)+(3*1)+(2*5)+(1*8)=102
102 % 10 = 2
So 116601-58-2 is a valid CAS Registry Number.
InChI:InChI=1/C8H10/c1-7-4-3-5-8(2)6-7/h3-6H,1-2H3/i1D3,2D3,3D,4D,5D,6D

116601-58-2SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 1,2,3,5-tetradeuterio-4,6-bis(trideuteriomethyl)benzene

1.2 Other means of identification

Product number -
Other names 1,3-Dimethylbenzene-d10

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:116601-58-2 SDS

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