4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine
![4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine Structure](https://image.chemsrc.com/caspic/051/30129-53-4.png)
4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine structure
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Common Name | 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine | ||
|---|---|---|---|---|
| CAS Number | 30129-53-4 | Molecular Weight | 168.58400 | |
| Density | N/A | Boiling Point | 233°C | |
| Molecular Formula | C6H5ClN4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine |
|---|---|
| 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.
| Boiling Point | 233°C |
|---|---|
| Molecular Formula | C6H5ClN4 |
| Molecular Weight | 168.58400 |
| Exact Mass | 168.02000 |
| PSA | 54.46000 |
| LogP | 1.31470 |
| InChIKey | OWBUPPWTPDJDHZ-UHFFFAOYSA-N |
| SMILES | Cc1nc(Cl)c2cn[nH]c2n1 |
| Storage condition | 2-8°C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|---|
| HS Code | 2933990090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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4-Chloro-6-meth... CAS#:30129-53-4 |
| Literature: Journal of Organic Chemistry, , vol. 23, p. 191,195 |
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~6%
4-Chloro-6-meth... CAS#:30129-53-4 |
| Literature: Smith, Adrian L.; D'Angelo, Noel D.; Bo, Yunxin Y.; Booker, Shon K.; Cee, Victor J.; Herberich, Brad; Hong, Fang-Tsao; Jackson, Claire L. M.; Lanman, Brian A.; Liu, Longbin; Nishimura, Nobuko; Pettus, Liping H.; Reed, Anthony B.; Tadesse, Seifu; Tamayo, Nuria A.; Wurz, Ryan P.; Yang, Kevin; Andrews, Kristin L.; Whittington, Douglas A.; McCarter, John D.; Miguel, Tisha San; Zalameda, Leeanne; Jiang, Jian; Subramanian, Raju; Mullady, Erin L.; Caenepeel, Sean; Freeman, Daniel J.; Wang, Ling; Zhang, Nancy; Wu, Tian; Hughes, Paul E.; Norman, Mark H. Journal of Medicinal Chemistry, 2012 , vol. 55, # 11 p. 5188 - 5219 |
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4-Chloro-6-meth... CAS#:30129-53-4 |
| Literature: Journal of Medicinal Chemistry, , vol. 55, # 11 p. 5188 - 5219 |
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~%
4-Chloro-6-meth... CAS#:30129-53-4 |
| Literature: Journal of Organic Chemistry, , vol. 23, p. 191,195 |
|
~%
4-Chloro-6-meth... CAS#:30129-53-4 |
| Literature: Journal of Medicinal Chemistry, , vol. 55, # 17 p. 7425 - 7436 |
![4H-Pyrazolo[3,4-d]pyrimidin-4-one,1,5-dihydro-6-methyl structure](https://image.chemsrc.com/caspic/399/30129-57-8.png)
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 2 | |
![1H-Pyrazolo[3,4-d]pyrimidin-4-amine,6-methyl structure](https://image.chemsrc.com/caspic/405/5326-80-7.png)
CAS#:5326-80-7![4H-Pyrazolo[3,4-d]pyrimidine-4-thione,1,5-dihydro-6-methyl structure](https://image.chemsrc.com/caspic/086/15986-11-5.png)
CAS#:15986-11-5This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933990090 |
|---|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. 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.
| QC-4047 |
| 4-chloro-6-methylpyrazolo<3,4-d>pyrimidine |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What English synonyms does 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine have? |
| A: English synonyms of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine: QC-4047, 4-chloro-6-methylpyrazolopyrimidine. |
| Q: What is the SMILES notation of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine? |
| A: SMILES notation of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine is Cc1nc(Cl)c2cn[nH]c2n1. |
| Q: What is the InChIKey of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine? |
| A: InChIKey of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine is OWBUPPWTPDJDHZ-UHFFFAOYSA-N. |
| Q: What is the English name of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine? |
| A: The English name of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine is 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine. |
| Q: What are the storage conditions for 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine? |
| A: Storage conditions for 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine: 2-8°C. |
| Q: What are the downstream products of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine? |
| A: Related downstream products(CAS) of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine: 5326-80-7;15986-11-5. |
| Q: What is the molecular weight of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine? |
| A: Molecular weight of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine is 168.58400. |
| Q: What are the upstream materials of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine? |
| A: Related upstream materials(CAS) of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine: 30129-57-8;14160-91-9;1780-26-3;117868-30-1. |
| Q: What is the LogP of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine? |
| A: LogP of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine is 1.31470. |
| Q: What is the polar surface area (PSA) of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine? |
| A: Polar surface area (PSA) of 4-Chloro-6-methyl-1H-pyrazolo[3,4-d]pyrimidine is 54.46000. |
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. |