4-oxo-4-(3-pyridinebutanal)
4-oxo-4-(3-pyridinebutanal) structure
|
Common Name | 4-oxo-4-(3-pyridinebutanal) | ||
|---|---|---|---|---|
| CAS Number | 76014-80-7 | Molecular Weight | 163.17300 | |
| Density | 1.129g/cm3 | Boiling Point | 327.8ºC at 760 mmHg | |
| Molecular Formula | C9H9NO2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 156.4ºC | |
Summary: 4-oxo-4-(pyridin-3-yl)butanal (4-oxo-4-(3-pyridinebutanal)，Chinese name: 4-氧代-4-(吡啶-3-基)丁醛)，CAS number: 76014-80-7，molecular formula: C9H9NO2，molecular weight: 163.17300。For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-oxo-4-(pyridin-3-yl)butanal |
|---|---|
| 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 | 1.129g/cm3 |
|---|---|
| Boiling Point | 327.8ºC at 760 mmHg |
| Molecular Formula | C9H9NO2 |
| Molecular Weight | 163.17300 |
| Flash Point | 156.4ºC |
| Exact Mass | 163.06300 |
| PSA | 47.03000 |
| LogP | 1.24340 |
| Index of Refraction | 1.518 |
| InChIKey | CFONOJVUTZAMCB-UHFFFAOYSA-N |
| SMILES | O=CCCC(=O)c1cccnc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933399090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
![2-[3-Oxo-3-(3-pyridyl)propyl]-1,3-dioxolane structure](https://image.chemsrc.com/caspic/045/109065-57-8.png)
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 7 | |
|---|---|
| DownStream 6 | |
CAS#:494-97-3
CAS#:494-98-4
CAS#:487-19-4
CAS#:3562-11-6
CAS#:22083-74-5
CAS#:86900-39-2This 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 collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-succinoylsemialdehyde-pyridine |
| 4-oxo-4-pyridin-3-yl-butyraldehyde |
| 4-oxo-4-pyridin-3-ylbutanal |
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 4-oxo-4-(pyridin-3-yl)butanal? |
| A: SMILES notation of 4-oxo-4-(pyridin-3-yl)butanal is O=CCCC(=O)c1cccnc1. |
| Q: What English synonyms does 4-oxo-4-(pyridin-3-yl)butanal have? |
| A: English synonyms of 4-oxo-4-(pyridin-3-yl)butanal: 3-succinoylsemialdehyde-pyridine, 4-oxo-4-pyridin-3-yl-butyraldehyde, 4-oxo-4-pyridin-3-ylbutanal. |
| Q: What is the polar surface area (PSA) of 4-oxo-4-(pyridin-3-yl)butanal? |
| A: Polar surface area (PSA) of 4-oxo-4-(pyridin-3-yl)butanal is 47.03000. |
| Q: What are the downstream products of 4-oxo-4-(pyridin-3-yl)butanal? |
| A: Related downstream products(CAS) of 4-oxo-4-(pyridin-3-yl)butanal: 494-97-3;494-98-4;487-19-4;3562-11-6;22083-74-5;86900-39-2. |
| Q: What is the LogP of 4-oxo-4-(pyridin-3-yl)butanal? |
| A: LogP of 4-oxo-4-(pyridin-3-yl)butanal is 1.24340. |
| Q: What is the English name of 4-oxo-4-(pyridin-3-yl)butanal? |
| A: The English name of 4-oxo-4-(pyridin-3-yl)butanal is 4-oxo-4-(pyridin-3-yl)butanal. |
| Q: What is the CAS number of 4-oxo-4-(pyridin-3-yl)butanal? |
| A: CAS number of 4-oxo-4-(pyridin-3-yl)butanal is 76014-80-7. |
| Q: What are the upstream materials of 4-oxo-4-(pyridin-3-yl)butanal? |
| A: Related upstream materials(CAS) of 4-oxo-4-(pyridin-3-yl)butanal: 109065-57-8;421557-52-0;59578-62-0;95091-91-1;59-67-6;16518-17-5;626-55-1. |
| Q: What is the InChIKey of 4-oxo-4-(pyridin-3-yl)butanal? |
| A: InChIKey of 4-oxo-4-(pyridin-3-yl)butanal is CFONOJVUTZAMCB-UHFFFAOYSA-N. |
| Q: What is the molecular formula of 4-oxo-4-(pyridin-3-yl)butanal? |
| A: Molecular formula of 4-oxo-4-(pyridin-3-yl)butanal is C9H9NO2. |
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. |