4-Hydroxy-5-chloro-2-methylthiopyrimidine
4-Hydroxy-5-chloro-2-methylthiopyrimidine structure
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Common Name | 4-Hydroxy-5-chloro-2-methylthiopyrimidine | ||
|---|---|---|---|---|
| CAS Number | 61044-94-8 | Molecular Weight | 176.62400 | |
| Density | 1.54 | Boiling Point | N/A | |
| Molecular Formula | C5H5ClN2OS | Melting Point | 258-260℃ | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one |
|---|---|
| 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 | 1.54 |
|---|---|
| Melting Point | 258-260℃ |
| Molecular Formula | C5H5ClN2OS |
| Molecular Weight | 176.62400 |
| Exact Mass | 175.98100 |
| PSA | 71.31000 |
| LogP | 1.55750 |
| InChIKey | UXTNYZWGVQQIEW-UHFFFAOYSA-N |
| SMILES | CSc1ncc(Cl)c(=O)[nH]1 |
| Storage condition | 2-8°C |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~48%
4-Hydroxy-5-chl... CAS#:61044-94-8 |
| Literature: PFIZER INC.; NAIR, Sajiv, Krishnan; PLANKEN, Simon, Paul Patent: WO2012/52948 A1, 2012 ; Location in patent: Page/Page column 53 ; WO 2012/052948 A1 |
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~%
4-Hydroxy-5-chl... CAS#:61044-94-8 |
| Literature: West; Barrett Journal of the American Chemical Society, 1954 , vol. 76, p. 3146 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
|---|---|
| DownStream 2 | |
CAS#:113138-11-7
CAS#:99469-85-9This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4(1H)-Pyrimidinone,5-chloro-2-(methylthio) |
| 5-Chlor-2-methylmercapto-3H-pyrimidin-4-on |
| 5-chloro-2-methylsulfanyl-3H-pyrimidin-4-one |
| 5-chloro-2-methylthio-4(1H)-pyrimidinone |
| 5-chloro-2-(methylthio)pyrimidin-4(3H)-one |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What English synonyms does 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one have? |
| A: English synonyms of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one: 4(1H)-Pyrimidinone,5-chloro-2-(methylthio), 5-Chlor-2-methylmercapto-3H-pyrimidin-4-on, 5-chloro-2-methylsulfanyl-3H-pyrimidin-4-one, 5-chloro-2-methylthio-4(1H)-pyrimidinone, 5-chloro-2-(methylthio)pyrimidin-4(3H)-one. |
| Q: What is the InChIKey of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one? |
| A: InChIKey of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one is UXTNYZWGVQQIEW-UHFFFAOYSA-N. |
| Q: What are the storage conditions for 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one? |
| A: Storage conditions for 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one: 2-8°C. |
| Q: What is the molecular weight of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one? |
| A: Molecular weight of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one is 176.62400. |
| Q: What is the molecular formula of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one? |
| A: Molecular formula of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one is C5H5ClN2OS. |
| Q: What is the polar surface area (PSA) of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one? |
| A: Polar surface area (PSA) of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one is 71.31000. |
| Q: What is the CAS number of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one? |
| A: CAS number of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one is 61044-94-8. |
| Q: What is the SMILES notation of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one? |
| A: SMILES notation of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one is CSc1ncc(Cl)c(=O)[nH]1. |
| Q: What is the LogP of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one? |
| A: LogP of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one is 1.55750. |
| Q: What are the downstream products of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one? |
| A: Related downstream products(CAS) of 5-chloro-2-methylsulfanyl-1H-pyrimidin-6-one: 113138-11-7;99469-85-9. |
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. |