≥99.96 atom% D, contains 0.03 % (v/v) TMS for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature,Argon charged Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 7 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Product Describtion:
Benzene-d6 (C6D6) is deuterated benzene that contains 0.03% (v/v) TMS (tetramethylsilane). Its Soret coefficient S(T) has been measured by transient holographic grating technique.Its synthesis,13C NMR, IR and MS spectra have been reported
Product Application:
Benzene-d6 (C6D6) may be used in the following:
Synthesis of isotopically labeled samples.
As a 1H and 13C-NMR solvent.
In the internal calibration of benzene stock solution
| Pubchem Sid | 528772372 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/528772372 |
| Canonical Smiles | C1=CC=CC=C1 |
| IUPAC Name | 1,2,3,4,5,6-hexadeuteriobenzene |
| InChIKey | UHOVQNZJYSORNB-MZWXYZOWSA-N |
| INCHI | 1S/C6H6/c1-2-4-6-5-3-1/h1-6H/i1D,2D,3D,4D,5D,6D |
| Isomeric SMILES | [2H]C1=C(C(=C(C(=C1[2H])[2H])[2H])[2H])[2H] |
| WGK Germany | 3 |
| Alternate CAS | 71-43-2（Unlabeled） |
| UN Number | 1114 |
| Packing Group | II |
| Molecular Weight | 84.15 |
| Beilstein | 1905426 |
| Reaxy-Rn | 969212 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=969212&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzene and substituted derivatives |
| Alternative Parents | Aromatic hydrocarbons Unsaturated hydrocarbons |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Monocyclic benzene moiety - Aromatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - 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 |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 E1620041 | Certificate of Analysis | Oct 16, 2023 | B100914 |
| G2315246 | Certificate of Analysis | Jun 21, 2023 | B100914 |
| G2315255 | Certificate of Analysis | Jun 21, 2023 | B100914 |
| B2221308 | Certificate of Analysis | Jan 12, 2022 | B100914 |
| Sensitivity | Moisture sensitive. |
|---|---|
| x_refractive_index | 1.497 |
| x_flash_point_drop_fahrenheit | 53.6℉ |
| x_flash_point_drop_centigrade | -11℃ |
| x_boil_point_char | 79.1°C |
| x_melt_point_char | 6.8°C |
| Molecular Weight | 84.150 g/mol |
| XLogP3 | 2.100 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 0 |
| Exact Mass | 84.0846 Da |
| Monoisotopic Mass | 84.0846 Da |
| Topological Polar Surface Area | 0.000 Ų |
| Heavy Atom Count | 6 |
| Formal Charge | 0 |
| Complexity | 15.500 |
| Isotope Atom Count | 6 |
| 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 |
