(4-BOC-AMINO-PIPERIDIN-1-YL)-NAPHTHALEN-2-YL-ACETICACID
(4-BOC-AMINO-PIPERIDIN-1-YL)-NAPHTHALEN-2-YL-ACETICACID structure
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Common Name | (4-BOC-AMINO-PIPERIDIN-1-YL)-NAPHTHALEN-2-YL-ACETICACID | ||
|---|---|---|---|---|
| CAS Number | 915707-65-2 | Molecular Weight | 191.02600 | |
| Density | 1.75g/cm3 | Boiling Point | 308.4ºC at 760 mmHg | |
| Molecular Formula | C5H7BrN2O | Melting Point | 94ºC | |
| MSDS | N/A | Flash Point | 140.3ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | (4-bromo-1-methylpyrazol-3-yl)methanol |
|---|---|
| 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 | 1.75g/cm3 |
|---|---|
| Boiling Point | 308.4ºC at 760 mmHg |
| Melting Point | 94ºC |
| Molecular Formula | C5H7BrN2O |
| Molecular Weight | 191.02600 |
| Flash Point | 140.3ºC |
| Exact Mass | 189.97400 |
| PSA | 38.05000 |
| LogP | 0.67490 |
| Index of Refraction | 1.621 |
| InChIKey | JFGLJTFTVBZOCB-UHFFFAOYSA-N |
| SMILES | Cn1cc(Br)c(CO)n1 |
| 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 | 2933199090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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(4-BOC-AMINO-PI... CAS#:915707-65-2 |
| Literature: NOVARTIS AG; BADIGER, Sangamesh; BEHNKE, Dirk; BETSCHART, Claudia; CHAUDHARI, Vinod; COTESTA, Simona; HINTERMANN, Samuel; LERCHNER, Andreas; LIMAM, Fatma; OFNER, Silvio; PANDIT, Chetan; WAGNER, Juergen Patent: WO2012/101487 A1, 2012 ; Location in patent: Page/Page column 85; 86 ; WO 2012/101487 A1 |
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(4-BOC-AMINO-PI... CAS#:915707-65-2 |
| Literature: US2011/281888 A1, ; Page/Page column 42 ; |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
|---|---|
| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933199090 |
|---|---|
| Summary | 2933199090. other compounds containing an unfused pyrazole 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 contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Phenotypic growth assay for Mycobacterium tuberculosis grown for 4 days on DPPC, chol...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4649948
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Name: Phenotypic growth assay for Mycobacterium tuberculosis grown for 3 days on 7H9, gluco...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4649949
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Name: Antibacterial activity against Acinetobacter baumannii ATCC 19606 (CO-ADD:GN_034); MI...
Source: ChEMBL
Target: Acinetobacter baumannii
External Id: CHEMBL4296188
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Name: Antibacterial activity against Pseudomonas aeruginosa ATCC 27853 (CO-ADD:GN_042); MIC...
Source: ChEMBL
Target: Pseudomonas aeruginosa
External Id: CHEMBL4296187
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Name: Antibacterial activity against Pseudomonas aeruginosa PAO397 [PAO1 d(mexAB-oprM) d(me...
Source: ChEMBL
Target: Pseudomonas aeruginosa
External Id: CHEMBL4296802
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| MFCD06202888 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of (4-bromo-1-methylpyrazol-3-yl)methanol? |
| A: Polar surface area (PSA) of (4-bromo-1-methylpyrazol-3-yl)methanol is 38.05000. |
| Q: What is the boiling point of (4-bromo-1-methylpyrazol-3-yl)methanol? |
| A: Boiling point of (4-bromo-1-methylpyrazol-3-yl)methanol is 308.4ºC at 760 mmHg. |
| Q: What English synonyms does (4-bromo-1-methylpyrazol-3-yl)methanol have? |
| A: English synonyms of (4-bromo-1-methylpyrazol-3-yl)methanol: MFCD06202888. |
| Q: What is the InChIKey of (4-bromo-1-methylpyrazol-3-yl)methanol? |
| A: InChIKey of (4-bromo-1-methylpyrazol-3-yl)methanol is JFGLJTFTVBZOCB-UHFFFAOYSA-N. |
| Q: What are the storage conditions for (4-bromo-1-methylpyrazol-3-yl)methanol? |
| A: Storage conditions for (4-bromo-1-methylpyrazol-3-yl)methanol: 2-8°C. |
| Q: What are the upstream materials of (4-bromo-1-methylpyrazol-3-yl)methanol? |
| A: Related upstream materials(CAS) of (4-bromo-1-methylpyrazol-3-yl)methanol: 211738-66-8;84547-86-4. |
| Q: What is the LogP of (4-bromo-1-methylpyrazol-3-yl)methanol? |
| A: LogP of (4-bromo-1-methylpyrazol-3-yl)methanol is 0.67490. |
| Q: What is the English name of (4-bromo-1-methylpyrazol-3-yl)methanol? |
| A: The English name of (4-bromo-1-methylpyrazol-3-yl)methanol is (4-bromo-1-methylpyrazol-3-yl)methanol. |
| Q: What is the SMILES notation of (4-bromo-1-methylpyrazol-3-yl)methanol? |
| A: SMILES notation of (4-bromo-1-methylpyrazol-3-yl)methanol is Cn1cc(Br)c(CO)n1. |
| Q: What is the CAS number of (4-bromo-1-methylpyrazol-3-yl)methanol? |
| A: CAS number of (4-bromo-1-methylpyrazol-3-yl)methanol is 915707-65-2. |
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. |