Isonicotinamide structure
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Common Name | Isonicotinamide | ||
|---|---|---|---|---|
| CAS Number | 1453-82-3 | Molecular Weight | 122.13 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 334.4±15.0 °C at 760 mmHg | |
| Molecular Formula | C6H6N2O | Melting Point | 155-157 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 156.0±20.4 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Use of IsonicotinamideIsonicotinamide is a biochemical reagent that can be used as a biological material or organic compound for life science related research. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | isonicotinamide |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | Isonicotinamide is a biochemical reagent that can be used as a biological material or organic compound for life science related research. |
|---|---|
| Related Catalog |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 334.4±15.0 °C at 760 mmHg |
| Melting Point | 155-157 °C(lit.) |
| Molecular Formula | C6H6N2O |
| Molecular Weight | 122.13 |
| Flash Point | 156.0±20.4 °C |
| Exact Mass | 122.048012 |
| PSA | 55.98000 |
| LogP | -0.28 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.570 |
| InChIKey | VFQXVTODMYMSMJ-UHFFFAOYSA-N |
| SMILES | NC(=O)c1ccncc1 |
| Water Solubility | 191.7 g/L (37 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 DATAMUTATION 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 | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi:Irritant |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| RTECS | NR9500000 |
| HS Code | 29333999 |
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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Targeting SRPK1 to control VEGF-mediated tumour angiogenesis in metastatic melanoma.
Br. J. Cancer 111(3) , 477-85, (2014) Current therapies for metastatic melanoma are targeted either at cancer mutations driving growth (e.g., vemurafenib) or immune-based therapies (e.g., ipilimumab). Tumour progression also requires angi... |
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[Fe(CN)5(isoniazid)](3-): an iron isoniazid complex with redox behavior implicated in tuberculosis therapy.
J. Inorg. Biochem. 140 , 236-44, (2014) Tuberculosis has re-emerged as a worldwide threat, which has motivated the development of new drugs. The antituberculosis complex Na3[Fe(CN)5(isoniazid)] (IQG607) in particular is of interest on accou... |
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Measuring induction times and crystal nucleation rates.
Faraday Discuss. 179 , 199-214, (2015) A large variation is observed in induction times measured under equal conditions in 1 ml solutions. Ruling out experimental errors, this variation originates from the nucleation process. The induction... |
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.
| 4-Pyridine carboxamide |
| MFCD00006432 |
| 4-pyridinecarboximidic acid |
| 4-Pyridinecarboxamide |
| EINECS 215-926-2 |
| 4-(HYDROXYIMINOMETHYL)PYRIDINE |
| Isonicotinamide |
| Pyridine-4-carboximidic acid |
| pyridine-4-carboxamide |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of isonicotinamide? |
| A: SMILES notation of isonicotinamide is NC(=O)c1ccncc1. |
| Q: What English synonyms does isonicotinamide have? |
| A: English synonyms of isonicotinamide: 4-Pyridine carboxamide, MFCD00006432, 4-pyridinecarboximidic acid, 4-Pyridinecarboxamide, EINECS 215-926-2, 4-(HYDROXYIMINOMETHYL)PYRIDINE, Isonicotinamide, Pyridine-4-carboximidic acid, pyridine-4-carboxamide. |
| Q: What are the uses of isonicotinamide? |
| A: Main uses of isonicotinamide: Isonicotinamide is a biochemical reagent that can be used as a biological material or organic compound for life science related research. |
| Q: What is the English name of isonicotinamide? |
| A: The English name of isonicotinamide is isonicotinamide. |
| Q: What is the LogP of isonicotinamide? |
| A: LogP of isonicotinamide is -0.28. |
| Q: What is the molecular formula of isonicotinamide? |
| A: Molecular formula of isonicotinamide is C6H6N2O. |
| Q: What is the InChIKey of isonicotinamide? |
| A: InChIKey of isonicotinamide is VFQXVTODMYMSMJ-UHFFFAOYSA-N. |
| Q: What is the molecular weight of isonicotinamide? |
| A: Molecular weight of isonicotinamide is 122.13. |
| Q: What are the upstream materials of isonicotinamide? |
| A: Related upstream materials(CAS) of isonicotinamide: 100-48-1;3731-53-1;14906-59-3;144223-31-4;696-54-8;38557-82-3;586-95-8;100-43-6;2196-13-6;55-22-1. |
| Q: How is the water solubility of isonicotinamide? |
| A: Water solubility of isonicotinamide: 191.7 g/L (37 ºC). |
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. |