≥99.5 atom% D for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships 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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Ethan(ol-d) (Ethanol-OD) is a deuterated ethanol in which the proton of OH group has been replaced by the deuterium (D) atom. It is a deuterium labeled solvent. It serves as a model compound for the Raman spectrometric evaluation of the fine structure of the OX (X = H, D) stretching vibrational profile arising from rotational isomerism. Triethylorthocarbonate has been employed as a precursor for the preparation of high isotopic purity ethanol-OD.
| Canonical Smiles | CCO |
|---|---|
| IUPAC Name | deuteriooxyethane |
| InChIKey | LFQSCWFLJHTTHZ-WFVSFCRTSA-N |
| INCHI | 1S/C2H6O/c1-2-3/h3H,2H2,1H3/i3D |
| Isomeric SMILES | [2H]OCC |
| Alternate CAS | 64-17-5（unlabelled） |
| PubChem CID | 123093 |
| Molecular Weight | 47.07 |
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 | Organic oxygen compounds |
| Class | Organooxygen compounds |
| Subclass | Alcohols and polyols |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Primary alcohols |
| Alternative Parents | Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Hydrocarbon derivative - Primary alcohol - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as primary alcohols. These are compounds comprising the primary alcohol functional group, with the general structure RCOH (R=alkyl, aryl). |
| External Descriptors | Not available |
| Flash Point(°C) | 12°C |
|---|---|
| Boil Point(°C) | 78 °C (lit.) |
| Melt Point(°C) | -114 °C (lit.) |
| Molecular Weight | 47.070 g/mol |
| XLogP3 | -0.100 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 47.0481 Da |
| Monoisotopic Mass | 47.0481 Da |
| Topological Polar Surface Area | 20.200 Ų |
| Heavy Atom Count | 3 |
| Formal Charge | 0 |
| Complexity | 2.800 |
| Isotope Atom Count | 1 |
| 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 |
| 1. Jianrong Shan, Haixin Guo, Jiajiang Zhou, Feng Shen, Mo Qiu, Jirui Yang, Richard Lee Smith Jr, Xinhua Qi. (2024) Efficient isomerization of glucose to fructose over Al-loaded functional lignin biopolymer. APPLIED CATALYSIS B-ENVIRONMENTAL, [PMID:] [10.1016/j.apcatb.2024.124095] |
| 2. Xuefei Chen, Hanlu Guo, Zhiwei Hu, Lei Dong, Jianhua Shen, Yihua Zhu, Chunzhong Li. (2025) Enhanced Lewis acid-base synergistic photocatalyst for selective benzimidazole synthesis coupled with hydrogen evolution. APPLIED CATALYSIS B-ENVIRONMENTAL, [PMID:] [10.1016/j.apcatb.2025.125982] |
