3-Cyanopyridine structure
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Common Name | 3-Cyanopyridine | ||
|---|---|---|---|---|
| CAS Number | 100-54-9 | Molecular Weight | 104.109 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 203.0±13.0 °C at 760 mmHg | |
| Molecular Formula | C6H4N2 | Melting Point | 48-52 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 84.4±0.0 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-pyridinecarbonitrile |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 203.0±13.0 °C at 760 mmHg |
| Melting Point | 48-52 °C(lit.) |
| Molecular Formula | C6H4N2 |
| Molecular Weight | 104.109 |
| Flash Point | 84.4±0.0 °C |
| Exact Mass | 104.037445 |
| PSA | 36.68000 |
| LogP | 0.50 |
| Vapour Pressure | 0.3±0.4 mmHg at 25°C |
| Index of Refraction | 1.540 |
| InChIKey | GZPHSAQLYPIAIN-UHFFFAOYSA-N |
| SMILES | N#Cc1cccnc1 |
| Stability | Incompatible with strong oxidizing agents, strong reducing agents, strong acids, strong bases. |
| Water Solubility | 140 g/L (20 ºC) |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302-H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xn:Harmful |
| Risk Phrases | R22;R36/37/38 |
| Safety Phrases | S22-S24/25-S36/37/39-S26 |
| RIDADR | 1325.0 |
| WGK Germany | 3 |
| RTECS | QT3030000 |
| Packaging Group | I; II; III |
| Hazard Class | 6.1 |
| HS Code | 2933399010 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 10 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933399090 |
|---|---|
| Summary | 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Akt-mediated regulation of antidepressant-sensitive serotonin transporter function, cell-surface expression and phosphorylation.
Biochem. J. 468 , 177-90, (2015) The serotonin [5-HT (5-hydroxytryptamine)] transporter (SERT) controls serotonergic neurotransmission in the brain by rapid clearance of 5-HT from the synaptic cleft into presynaptic neurons. SERTs ar... |
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Self-assembled hybrid metal oxide base catalysts prepared by simply mixing with organic modifiers.
Nat. Commun. 6 , 8580, (2015) Multidentate materials formed by simply mixing heterogeneous and homogeneous components are promising for construction of versatile active sites on the surface of heterogeneous compounds, however, to ... |
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The WNT/β-Catenin Pathway Is a Transcriptional Regulator of CYP2E1, CYP1A2, and Aryl Hydrocarbon Receptor Gene Expression in Primary Human Hepatocytes.
Mol. Pharmacol. 86(6) , 624-34, (2014) The wingless-type MMTV integration site family (WNT)/β-catenin/adenomatous polyposis coli (CTNNB1/APC) pathway has been identified as a regulator of drug-metabolizing enzymes in the rodent liver. Conv... |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| pyridine-3-carbonitrile |
| EINECS 202-863-0 |
| 3-Cyanopyridine |
| MFCD00006372 |
| 3-Pyridinecarbonitrile |
| Nicotinonitrile |
| 3-Pyridinenitrile |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular formula of 3-pyridinecarbonitrile? |
| A: Molecular formula of 3-pyridinecarbonitrile is C6H4N2. |
| Q: What is the melting point of 3-pyridinecarbonitrile? |
| A: Melting point of 3-pyridinecarbonitrile is 48-52 °C(lit.). |
| Q: What is the SMILES notation of 3-pyridinecarbonitrile? |
| A: SMILES notation of 3-pyridinecarbonitrile is N#Cc1cccnc1. |
| Q: What English synonyms does 3-pyridinecarbonitrile have? |
| A: English synonyms of 3-pyridinecarbonitrile: pyridine-3-carbonitrile, EINECS 202-863-0, 3-Cyanopyridine, MFCD00006372, 3-Pyridinecarbonitrile, Nicotinonitrile, 3-Pyridinenitrile. |
| Q: What is the molecular weight of 3-pyridinecarbonitrile? |
| A: Molecular weight of 3-pyridinecarbonitrile is 104.109. |
| Q: What is the LogP of 3-pyridinecarbonitrile? |
| A: LogP of 3-pyridinecarbonitrile is 0.50. |
| Q: What are the downstream products of 3-pyridinecarbonitrile? |
| A: Related downstream products(CAS) of 3-pyridinecarbonitrile: 110684-29-2;105192-41-4;106881-77-0;3731-52-0;1656-94-6;91192-30-2;41051-03-0;97316-55-7;110911-10-9;110911-12-1. |
| Q: What is the boiling point of 3-pyridinecarbonitrile? |
| A: Boiling point of 3-pyridinecarbonitrile is 203.0±13.0 °C at 760 mmHg. |
| Q: What is the safety information for 3-pyridinecarbonitrile? |
| A: Safety information for 3-pyridinecarbonitrile: S22-S24/25-S36/37/39-S26. |
| Q: What is the InChIKey of 3-pyridinecarbonitrile? |
| A: InChIKey of 3-pyridinecarbonitrile is GZPHSAQLYPIAIN-UHFFFAOYSA-N. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |
| Henan Tianfu Chemical Co., Ltd. |
| Zhongshan Xingrui Chemical Co. , Ltd. |