Deuterated benzene

Deuterated benzene

Identifiers
CAS Number	1076-43-3 Y
3D model (JSmol)	Interactive image
Beilstein Reference	1905426
ChemSpider	64671 Y
ECHA InfoCard	100.012.784
EC Number	214-061-8
PubChem CID	71601
UN number	1114
InChI InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H/i1D,2D,3D,4D,5D,6D Y Key: UHOVQNZJYSORNB-MZWXYZOWSA-N Y
SMILES [2H]c1c([2H])c([2H])c([2H])c([2H])c1[2H]
Properties
Chemical formula	C62H6
Molar mass	84.1488 g mol−1
Density	0.950 g cm−3
Melting point	7 °C; 44 °F; 280 K
Boiling point	79 °C; 174 °F; 352 K
Thermochemistry
Heat capacity (C)	152.46 J K−1 mol−1
Hazards
EU classification (DSD) (outdated)	F T
R-phrases (outdated)	R45, R46, R11, R36/38, R48/23/24/25, R65
S-phrases (outdated)	S53, S45
NFPA 704	3 2 0
Flash point	−11 °C (12 °F; 262 K)
Related compounds
Related compounds	Benzene
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
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Infobox references

Deuterated benzene (C₆D₆) is a form (called an isotopologue) of benzene (C₆H₆) in which the hydrogen atom ("H") is replaced with deuterium (heavy hydrogen) isotope ("D"). Deuterated benzene is a common solvent used in NMR spectroscopy.