| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-05-27 01:55:21 UTC |
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| Update Date | 2016-11-09 01:22:37 UTC |
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| Accession Number | CHEM042229 |
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| Identification |
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| Common Name | formate |
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| Class | Small Molecule |
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| Description | A monocarboxylic acid anion that is the conjugate base of formic acid. Induces severe metabolic acidosis and ocular injury in human subjects. |
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| Contaminant Sources | |
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| Contaminant Type | Not Available |
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| Chemical Structure | |
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| Synonyms | | Value | Source |
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| Aminate | ChEBI | | Formiate | ChEBI | | Formic acid, ion(1-) | ChEBI | | Formylate | ChEBI | | HCO2 Anion | ChEBI | | Hydrogen carboxylate | ChEBI | | Methanoate | ChEBI | | Aminic acid | Generator | | Formiic acid | Generator | | Formate, ion(1-) | Generator | | Formylic acid | Generator | | Hydrogen carboxylic acid | Generator | | Methanoic acid | Generator | | Formic acid | Generator | | Aluminum formate | MeSH | | Ammonium formate | MeSH | | Ammonium tetraformate | MeSH | | Calcium formate | MeSH | | Chromic formate | MeSH | | Cobalt(II) formate dihydrate | MeSH | | Cobaltous formate | MeSH | | Cupric formate | MeSH | | Formic acid, 14C-labeled | MeSH | | Formic acid, aluminum salt | MeSH | | Formic acid, ammonium (2:1) salt | MeSH | | Formic acid, ammonium (4:1) salt | MeSH | | Formic acid, ammonium salt | MeSH | | Formic acid, cadmium salt | MeSH | | Formic acid, calcium salt | MeSH | | Formic acid, cesium salt | MeSH | | Formic acid, cobalt (+2) salt | MeSH | | Formic acid, copper (+2) salt | MeSH | | Formic acid, copper salt | MeSH | | Formic acid, copper, ammonium salt | MeSH | | Formic acid, copper, nickel salt | MeSH | | Formic acid, cromium (+3) salt | MeSH | | Formic acid, cromium (+3), sodium (4:1:1) salt | MeSH | | Formic acid, lead (+2) salt | MeSH | | Formic acid, lead salt | MeSH | | Formic acid, lithium salt | MeSH | | Formic acid, magnesium salt | MeSH | | Formic acid, nickel (+2) salt | MeSH | | Formic acid, nickel salt | MeSH | | Formic acid, potassium salt | MeSH | | Formic acid, rubidium salt | MeSH | | Formic acid, sodium salt | MeSH | | Formic acid, sodium salt, 13C-labeled | MeSH | | Formic acid, sodium salt, 14C-labeled | MeSH | | Formic acid, strontium salt | MeSH | | Formic acid, thallium (+1) salt | MeSH | | Formic acid, zinc salt | MeSH | | Lead formate | MeSH | | Lithium formate | MeSH | | Magnesium formate | MeSH | | Nickel formate | MeSH | | Nickel formate dihydrate | MeSH | | Potassium formate | MeSH | | Sodium formate | MeSH | | Strontium formate | MeSH | | Zinc formate | MeSH |
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| Chemical Formula | CHO2 |
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| Average Molecular Mass | 45.017 g/mol |
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| Monoisotopic Mass | 44.998 g/mol |
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| CAS Registry Number | Not Available |
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| IUPAC Name | formate |
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| Traditional Name | formate |
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| SMILES | [O-]C=O |
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| InChI Identifier | InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3)/p-1 |
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| InChI Key | BDAGIHXWWSANSR-UHFFFAOYSA-M |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as carboxylic acids. Carboxylic acids are compounds containing a carboxylic acid group with the formula -C(=O)OH. |
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| Kingdom | Organic compounds |
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| Super Class | Organic acids and derivatives |
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| Class | Carboxylic acids and derivatives |
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| Sub Class | Carboxylic acids |
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| Direct Parent | Carboxylic acids |
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| Alternative Parents | |
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| Substituents | - Monocarboxylic acid or derivatives
- Carboxylic acid
- Organic oxygen compound
- Organic oxide
- Hydrocarbon derivative
- Organooxygen compound
- Carbonyl group
- Organic anion
- Aliphatic acyclic compound
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| Molecular Framework | Aliphatic acyclic compounds |
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| External Descriptors | |
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| Biological Properties |
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| Status | Detected and Not Quantified |
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| Origin | Not Available |
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| Cellular Locations | Not Available |
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| Biofluid Locations | Not Available |
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| Tissue Locations | Not Available |
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| Pathways | Not Available |
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| Applications | Not Available |
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| Biological Roles | Not Available |
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| Chemical Roles | Not Available |
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| Physical Properties |
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| State | Not Available |
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| Appearance | Not Available |
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| Experimental Properties | | Property | Value |
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| Melting Point | Not Available | | Boiling Point | Not Available | | Solubility | Not Available |
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| Predicted Properties | |
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| Spectra |
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| Spectra | | Spectrum Type | Description | Splash Key | View |
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| Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Positive | splash10-0002-9000000000-9548e9a4076b2b4fbcb9 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Positive | splash10-0002-9000000000-ff014b7fdcb53c79dee2 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Positive | splash10-000t-9000000000-b24b9e2e2c63346e2637 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Negative | splash10-0006-9000000000-858382c65bcfcf3dfb45 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Negative | splash10-0006-9000000000-a2f9bca97cc287614d0f | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Negative | splash10-0006-9000000000-8932be077e998f2122a8 | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum |
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| Toxicity Profile |
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| Route of Exposure | Not Available |
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| Mechanism of Toxicity | Not Available |
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| Metabolism | Not Available |
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| Toxicity Values | Not Available |
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| Lethal Dose | Not Available |
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| Carcinogenicity (IARC Classification) | Not Available |
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| Uses/Sources | Not Available |
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| Minimum Risk Level | Not Available |
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| Health Effects | Not Available |
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| Symptoms | Not Available |
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| Treatment | Not Available |
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| Concentrations |
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| Not Available |
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| External Links |
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| DrugBank ID | Not Available |
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| HMDB ID | HMDB0304356 |
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| FooDB ID | FDB030863 |
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| Phenol Explorer ID | Not Available |
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| KNApSAcK ID | C00031754 |
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| BiGG ID | Not Available |
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| BioCyc ID | FORMATE |
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| METLIN ID | Not Available |
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| PDB ID | Not Available |
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| Wikipedia Link | Formate |
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| Chemspider ID | 277 |
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| ChEBI ID | 15740 |
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| PubChem Compound ID | Not Available |
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| Kegg Compound ID | Not Available |
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| YMDB ID | YMDB01025 |
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| ECMDB ID | Not Available |
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| References |
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| Synthesis Reference | Not Available |
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| MSDS | Not Available |
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| General References | |
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