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Sigma-Aldrich

Benzene-D6

deuteration degree min. 99.5% for NMR spectroscopy MagniSolv™

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Synonym(s):
Benzene-D6, Hexadeuterobenzene
Empirical Formula (Hill Notation):
C6D6
CAS Number:
1076-43-3
Molecular Weight:
84.15
MDL number:
MFCD00003010
UNSPSC Code:
12142201
EC Index Number:
214-061-8
NACRES:
NA.22

vapor pressure

101 hPa ( 20 °C)

Quality Level

200

isotopic purity

≥99.5 atom % D

form

liquid

autoignition temp.

555 °C

potency

930 mg/kg LD50, oral (Rat)
>8260 mg/kg LD50, skin (Rabbit)

expl. lim.

1.4-8.0 % (v/v)

technique(s)

NMR: suitable

impurities

≤0.02% Water (HO) (NMR)

kinematic viscosity

0.78 cSt(20 °C)

bp

79 °C/1013 hPa

mp

6.7 °C

transition temp

flash point -11 °C

density

0.95 g/cm3 at 20 °C

storage temp.

no temp limit

InChI

1S/C6H6/c1-2-4-6-5-3-1/h1-6H/i1D,2D,3D,4D,5D,6D

InChI key

UHOVQNZJYSORNB-MZWXYZOWSA-N

General description

A wide range of MagniSolv deuterated solvents with extremely low residual water, excellent chemical purity, and the highest isotopic enrichment available can satisfy the most demanding requirements of researchers. Depending on application and sensitivity of the NMR spectrometer our offer solvents with deuteration degrees between 98% and 99.96%. In case of all the water soluble deuterated standard products, water content is specified according to both Karl Fischer and NMR.

Application

Benzene-D6 deuteration degree min. 99.5% for NMR spectroscopy MagniSolv. CAS 1076-43-3, molar mass 84.15 g/mol.

Analysis Note

Deuteration degree: ≥ 99.5 %
Water (NMR, HO): ≤ 0.02 %
Performance test (NMR-spectrum): passes test

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Legal Information

MAGNISOLV is a trademark of Merck KGaA, Darmstadt, Germany

Signal Word

Danger

Hazard Classifications

Aquatic Chronic 3 - Asp. Tox. 1 - Carc. 1A - Eye Irrit. 2 - Flam. Liq. 2 - Muta. 1B - Skin Irrit. 2 - STOT RE 1

Target Organs

Blood

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

12.2 °F - closed cup

Flash Point(C)

-11 °C - closed cup

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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