| Pubchem Sid | 504756896 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504756896 |
| Canonical Smiles | C(=O)O |
| IUPAC Name | deuterio deuterioformate |
| InChIKey | BDAGIHXWWSANSR-PFUFQJKNSA-N |
| INCHI | 1S/CH2O2/c2-1-3/h1H,(H,2,3)/i1D/hD |
| Isomeric SMILES | [2H]C(=O)O[2H] |
| WGK Germany | 1 |
| UN Number | 1779 |
| Packing Group | II |
| Molecular Weight | 48.04 |
| Reaxy-Rn | 1209246 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1209246&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 | Organic acids and derivatives |
| Class | Carboxylic acids and derivatives |
| Subclass | Carboxylic acids |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Carboxylic acids |
| Alternative Parents | Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as carboxylic acids. These are compounds containing a carboxylic acid group with the formula -C(=O)OH. |
| 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 |
|---|---|---|---|
 B2226436 | Certificate of Analysis | Dec 12, 2025 | D121276 |
| H2130139 | Certificate of Analysis | Jun 09, 2025 | D121276 |
| H2512126 | Certificate of Analysis | May 23, 2025 | D121276 |
| E2530298 | Certificate of Analysis | May 23, 2025 | D121276 |
| E2530299 | Certificate of Analysis | May 23, 2025 | D121276 |
| E2530300 | Certificate of Analysis | May 23, 2025 | D121276 |
| E2530301 | Certificate of Analysis | May 23, 2025 | D121276 |
| J2421463 | Certificate of Analysis | Oct 12, 2024 | D121276 |
| J2421455 | Certificate of Analysis | Oct 12, 2024 | D121276 |
| J2412279 | Certificate of Analysis | Jul 04, 2024 | D121276 |
| J2412280 | Certificate of Analysis | Jul 04, 2024 | D121276 |
| H2323607 | Certificate of Analysis | Aug 11, 2023 | D121276 |
| H2323608 | Certificate of Analysis | Aug 11, 2023 | D121276 |
| H2323612 | Certificate of Analysis | Aug 11, 2023 | D121276 |
| H2323622 | Certificate of Analysis | Aug 11, 2023 | D121276 |
| C23111235 | Certificate of Analysis | Jan 13, 2023 | D121276 |
| C23111210 | Certificate of Analysis | Jan 13, 2023 | D121276 |
| B2226403 | Certificate of Analysis | Jan 19, 2022 | D121276 |
| Boil Point(°C) | 100.8°C |
|---|---|
| Melt Point(°C) | 8.2-8.4°C |
| Molecular Weight | 48.038 g/mol |
| XLogP3 | -0.200 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 48.018 Da |
| Monoisotopic Mass | 48.018 Da |
| Topological Polar Surface Area | 37.300 Ų |
| Heavy Atom Count | 3 |
| Formal Charge | 0 |
| Complexity | 10.300 |
| Isotope Atom Count | 2 |
| 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. Yue Xiao, Haodong Huang, Shangpu Zhuang, Dong Yang. (2024) Probing the sites on metal oxide cluster nodes of metal organic framework MIL-96, MIL-100 and MIL-110. CHEMICAL ENGINEERING JOURNAL, [PMID:] [10.1016/j.cej.2024.151380] |
