| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-05-19 03:48:50 UTC |
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| Update Date | 2016-11-09 01:14:29 UTC |
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| Accession Number | CHEM012042 |
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| Identification |
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| Common Name | 2,2-Bipyridine |
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| Class | Small Molecule |
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| Description | A bipyridine in which the two pyridine moieties are linked by a bond between positions C-2 and C-2'. |
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| Contaminant Sources | - HPV EPA Chemicals
- STOFF IDENT Compounds
- ToxCast & Tox21 Chemicals
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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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| 2,2'-Bipyridin | ChEBI | | 2,2'-Bipyridyl | ChEBI | | 2,2'-Dipyridine | ChEBI | | 2,2'-Dipyridyl | ChEBI | | 2-(2-Pyridyl)pyridine | ChEBI | | alpha,Alpha'-bipyridine | ChEBI | | alpha,Alpha'-bipyridyl | ChEBI | | alpha,Alpha'-dipyridine | ChEBI | | alpha,Alpha'-dipyridyl | ChEBI | | bpy | ChEBI | | a,Alpha'-bipyridine | Generator | | Α,alpha'-bipyridine | Generator | | a,Alpha'-bipyridyl | Generator | | Α,alpha'-bipyridyl | Generator | | a,Alpha'-dipyridine | Generator | | Α,alpha'-dipyridine | Generator | | a,Alpha'-dipyridyl | Generator | | Α,alpha'-dipyridyl | Generator | | Dipyridyl, 2,2 | HMDB | | 2,2-Dipyridyl | HMDB | | 2,2 Dipyridyl | HMDB | | 2,2 Bipyridine | HMDB | | alpha,alpha Dipyridyl | HMDB | | 2,2 Bipyridyl | HMDB | | 2,2-Bipyridyl | HMDB | | 2,2' Dipyridyl | HMDB | | Dipyridyl, 2,2' | HMDB | | alpha,alpha-Dipyridyl | HMDB | | 2,2-Bipyridine | HMDB | | 2,2' Bipyridine | HMDB | | Bipyridyl | HMDB |
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| Chemical Formula | C10H8N2 |
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| Average Molecular Mass | 156.184 g/mol |
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| Monoisotopic Mass | 156.069 g/mol |
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| CAS Registry Number | 366-18-7 |
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| IUPAC Name | 2,2'-bipyridine |
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| Traditional Name | bipyridyl |
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| SMILES | C1=CC=C(N=C1)C1=CC=CC=N1 |
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| InChI Identifier | InChI=1S/C10H8N2/c1-3-7-11-9(5-1)10-6-2-4-8-12-10/h1-8H |
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| InChI Key | ROFVEXUMMXZLPA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as bipyridines and oligopyridines. These are organic compounds containing two pyridine rings linked to each other. |
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| Kingdom | Organic compounds |
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| Super Class | Organoheterocyclic compounds |
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| Class | Pyridines and derivatives |
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| Sub Class | Bipyridines and oligopyridines |
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| Direct Parent | Bipyridines and oligopyridines |
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| Alternative Parents | |
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| Substituents | - Bipyridine
- Heteroaromatic compound
- Azacycle
- Organic nitrogen compound
- Organopnictogen compound
- Hydrocarbon derivative
- Organonitrogen compound
- Aromatic heteromonocyclic compound
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| Molecular Framework | Aromatic heteromonocyclic 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 GC-MS | Predicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positive | splash10-0a4i-1900000000-6b41835e3823a3506206 | Spectrum | | Predicted GC-MS | Predicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positive | Not Available | Spectrum | | LC-MS/MS | LC-MS/MS Spectrum - LC-ESI-QFT 10V, positive | splash10-0a4i-0900000000-ae997d751927c2f42923 | Spectrum | | LC-MS/MS | LC-MS/MS Spectrum - 35V, Positive | splash10-0a4i-0900000000-ae997d751927c2f42923 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Positive | splash10-0a4i-0900000000-6ab0e30022201b78804b | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Positive | splash10-0a4i-0900000000-741cd79f229e23cfee99 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Positive | splash10-0udi-4900000000-7f2ac703600a1b786f0a | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Negative | splash10-0a4i-0900000000-c81ab3e67b048e47b8c2 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Negative | splash10-0a4i-0900000000-d479cfedfd389d5ba2bf | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Negative | splash10-0a6r-2900000000-7b4e15531554572c564c | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Positive | splash10-0a4i-0900000000-8a6bf55263d2e8824c17 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Positive | splash10-0a59-0900000000-c723d829599eff3e73f6 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Positive | splash10-0w33-3900000000-13d338e4bbfabd9cf3ba | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Negative | splash10-0a4i-0900000000-55ef27dd0ecfd19d8864 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Negative | splash10-0a4i-0900000000-55ef27dd0ecfd19d8864 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Negative | splash10-0zfr-0900000000-24b2abb55c918013fb94 | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C NMR Spectrum | Not Available | Spectrum | | 1D NMR | 1H NMR Spectrum | Not Available | Spectrum | | 1D NMR | 13C 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 | HMDB0245352 |
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| FooDB ID | Not Available |
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| Phenol Explorer ID | Not Available |
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| KNApSAcK ID | Not Available |
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| BiGG ID | Not Available |
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| BioCyc ID | CPD-8819 |
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| METLIN ID | Not Available |
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| PDB ID | Not Available |
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| Wikipedia Link | 2,2%27-Bipyridine |
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| Chemspider ID | 13867714 |
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| ChEBI ID | 30351 |
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| PubChem Compound ID | 1474 |
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| Kegg Compound ID | Not Available |
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| YMDB ID | Not Available |
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| ECMDB ID | ECMDB20251 |
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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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