9H-Purine, 6-chloro-8-methyl
9H-Purine, 6-chloro-8-methyl structure
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Common Name | 9H-Purine, 6-chloro-8-methyl | ||
|---|---|---|---|---|
| CAS Number | 92001-52-0 | Molecular Weight | 168.58400 | |
| Density | 1.69g/cm3 | Boiling Point | 261.2ºC at 760mmHg | |
| Molecular Formula | C6H5ClN4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 111.8ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 6-Chloro-8-methyl-9H-purine |
|---|---|
| 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 | 1.69g/cm3 |
|---|---|
| Boiling Point | 261.2ºC at 760mmHg |
| Molecular Formula | C6H5ClN4 |
| Molecular Weight | 168.58400 |
| Flash Point | 111.8ºC |
| Exact Mass | 168.02000 |
| PSA | 54.46000 |
| LogP | 1.31470 |
| Index of Refraction | 1.781 |
| InChIKey | MZYQXIIORWCBHF-UHFFFAOYSA-N |
| SMILES | Cc1nc2ncnc(Cl)c2[nH]1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933990090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~41%
9H-Purine, 6-ch... CAS#:92001-52-0 |
| Literature: Mornet, Rene; Leonard, Nelson J.; Theiler, Jane B.; Doree, Marcel Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1984 , # 5 p. 879 - 885 |
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~73%
9H-Purine, 6-ch... CAS#:92001-52-0 |
| Literature: Hocek, Michal; Hockova, Dana; Dvorakova, Hana Synthesis, 2004 , # 6 p. 889 - 894 |
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~%
9H-Purine, 6-ch... CAS#:92001-52-0 |
| Literature: Synthesis, , # 6 p. 889 - 894 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
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| DownStream 2 | |
CAS#:16973-94-7
CAS#:1126-23-4This 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 contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
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Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 6-chloro-8-methyl-7H-purine |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the boiling point of 6-Chloro-8-methyl-9H-purine? |
| A: Boiling point of 6-Chloro-8-methyl-9H-purine is 261.2ºC at 760mmHg. |
| Q: What are the upstream materials of 6-Chloro-8-methyl-9H-purine? |
| A: Related upstream materials(CAS) of 6-Chloro-8-methyl-9H-purine: 50609-15-9;239784-24-8;218431-07-3. |
| Q: What is the LogP of 6-Chloro-8-methyl-9H-purine? |
| A: LogP of 6-Chloro-8-methyl-9H-purine is 1.31470. |
| Q: What is the CAS number of 6-Chloro-8-methyl-9H-purine? |
| A: CAS number of 6-Chloro-8-methyl-9H-purine is 92001-52-0. |
| Q: What is the InChIKey of 6-Chloro-8-methyl-9H-purine? |
| A: InChIKey of 6-Chloro-8-methyl-9H-purine is MZYQXIIORWCBHF-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of 6-Chloro-8-methyl-9H-purine? |
| A: SMILES notation of 6-Chloro-8-methyl-9H-purine is Cc1nc2ncnc(Cl)c2[nH]1. |
| Q: What is the polar surface area (PSA) of 6-Chloro-8-methyl-9H-purine? |
| A: Polar surface area (PSA) of 6-Chloro-8-methyl-9H-purine is 54.46000. |
| Q: What are the downstream products of 6-Chloro-8-methyl-9H-purine? |
| A: Related downstream products(CAS) of 6-Chloro-8-methyl-9H-purine: 16973-94-7;1126-23-4. |
| Q: What English synonyms does 6-Chloro-8-methyl-9H-purine have? |
| A: English synonyms of 6-Chloro-8-methyl-9H-purine: 6-chloro-8-methyl-7H-purine. |
| Q: What is the molecular weight of 6-Chloro-8-methyl-9H-purine? |
| A: Molecular weight of 6-Chloro-8-methyl-9H-purine is 168.58400. |
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. |