4-Benzyloxy-2-nitrotoluene
4-Benzyloxy-2-nitrotoluene structure
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Common Name | 4-Benzyloxy-2-nitrotoluene | ||
|---|---|---|---|---|
| CAS Number | 24239-67-6 | Molecular Weight | 243.25800 | |
| Density | 1.202g/cm3 | Boiling Point | 389.3ºC at 760 mmHg | |
| Molecular Formula | C14H13NO3 | Melting Point | 60-62ºC | |
| MSDS | N/A | Flash Point | 169.7ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-Benzyloxy-2-nitrotoluene |
|---|---|
| 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 | 1.202g/cm3 |
|---|---|
| Boiling Point | 389.3ºC at 760 mmHg |
| Melting Point | 60-62ºC |
| Molecular Formula | C14H13NO3 |
| Molecular Weight | 243.25800 |
| Flash Point | 169.7ºC |
| Exact Mass | 243.09000 |
| PSA | 55.05000 |
| LogP | 4.00540 |
| Vapour Pressure | 6.47E-06mmHg at 25°C |
| Index of Refraction | 1.595 |
| InChIKey | DGMVXGHRFDVQHC-UHFFFAOYSA-N |
| SMILES | Cc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Risk Phrases | 20/21/22 |
|---|---|
| Safety Phrases | 24/25-36/37 |
| HS Code | 2909309090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~99%
4-Benzyloxy-2-n... CAS#:24239-67-6 |
| Literature: LAUTENS, Mark; FANG, Yuanqing Patent: WO2006/47888 A1, 2006 ; Location in patent: Page/Page column 82-83 ; |
|
~95%
4-Benzyloxy-2-n... CAS#:24239-67-6 |
| Literature: Ohkubo, Mitsuru; Nishimura, Teruyuki; Jona, Hideki; Honma, Teruki; Morishima, Hajime Tetrahedron, 1996 , vol. 52, # 24 p. 8099 - 8112 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 6 | |
CAS#:40047-23-2
CAS#:19499-88-8![1-[2-(2-nitro-4-phenylmethoxyphenyl)ethenyl]pyrrolidine structure](https://image.chemsrc.com/caspic/324/153805-86-8.png)
CAS#:153805-86-8
CAS#:15903-94-3
CAS#:2380-86-1
CAS#:40047-22-1This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2909309090 |
|---|---|
| Summary | 2909309090 other aromatic ethers and their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Dicer-mediated maturation of pre-microRNA
Source: Center for Chemical Genomics, University of Michigan
Target: N/A
External Id: TargetID_659_CEMA
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Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
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|
Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
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Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| MFCD00100651 |
| 1-methyl-2-nitro-4-phenylmethoxybenzene |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of 4-Benzyloxy-2-nitrotoluene? |
| A: LogP of 4-Benzyloxy-2-nitrotoluene is 4.00540. |
| Q: What is the English name of 4-Benzyloxy-2-nitrotoluene? |
| A: The English name of 4-Benzyloxy-2-nitrotoluene is 4-Benzyloxy-2-nitrotoluene. |
| Q: What is the InChIKey of 4-Benzyloxy-2-nitrotoluene? |
| A: InChIKey of 4-Benzyloxy-2-nitrotoluene is DGMVXGHRFDVQHC-UHFFFAOYSA-N. |
| Q: What is the molecular weight of 4-Benzyloxy-2-nitrotoluene? |
| A: Molecular weight of 4-Benzyloxy-2-nitrotoluene is 243.25800. |
| Q: What is the safety information for 4-Benzyloxy-2-nitrotoluene? |
| A: Safety information for 4-Benzyloxy-2-nitrotoluene: 24/25-36/37. |
| Q: What are the upstream materials of 4-Benzyloxy-2-nitrotoluene? |
| A: Related upstream materials(CAS) of 4-Benzyloxy-2-nitrotoluene: 2042-14-0;100-39-0;100-44-7. |
| Q: What is the SMILES notation of 4-Benzyloxy-2-nitrotoluene? |
| A: SMILES notation of 4-Benzyloxy-2-nitrotoluene is Cc1ccc(OCc2ccccc2)cc1[N+](=O)[O-]. |
| Q: What is the boiling point of 4-Benzyloxy-2-nitrotoluene? |
| A: Boiling point of 4-Benzyloxy-2-nitrotoluene is 389.3ºC at 760 mmHg. |
| Q: What is the CAS number of 4-Benzyloxy-2-nitrotoluene? |
| A: CAS number of 4-Benzyloxy-2-nitrotoluene is 24239-67-6. |
| Q: What is the melting point of 4-Benzyloxy-2-nitrotoluene? |
| A: Melting point of 4-Benzyloxy-2-nitrotoluene is 60-62ºC. |
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. |