Benzoic acid, 4-nitro-,propyl ester
Benzoic acid, 4-nitro-,propyl ester structure
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Common Name | Benzoic acid, 4-nitro-,propyl ester | ||
|---|---|---|---|---|
| CAS Number | 94-22-4 | Molecular Weight | 209.19900 | |
| Density | 1.214g/cm3 | Boiling Point | 328.1ºC at 760 mmHg | |
| Molecular Formula | C10H11NO4 | 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 | propyl 4-nitrobenzoate |
|---|---|
| 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 | 1.214g/cm3 |
|---|---|
| Boiling Point | 328.1ºC at 760 mmHg |
| Molecular Formula | C10H11NO4 |
| Molecular Weight | 209.19900 |
| Exact Mass | 209.06900 |
| PSA | 72.12000 |
| LogP | 2.68480 |
| Index of Refraction | 1.537 |
| InChIKey | KXUOYHZSTGGNCK-UHFFFAOYSA-N |
| SMILES | CCCOC(=O)c1ccc([N+](=O)[O-])cc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2916399090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~93%
Benzoic acid, 4... CAS#:94-22-4 |
| Literature: Kiran; Ikeda, Reiko; Sakai, Norio; Konakahara, Takeo Synthesis, 2010 , # 2 art. no. F16609SS, p. 276 - 282 |
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~90%
Benzoic acid, 4... CAS#:94-22-4 |
| Literature: Takimoto, Seiji; Abe, Naomi; Kodera, Yasushi; Ohta, Hiroshi Bulletin of the Chemical Society of Japan, 1983 , vol. 56, # 2 p. 639 - 640 |
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~87%
Benzoic acid, 4... CAS#:94-22-4 |
| Literature: Yu, Mingxin; Wen, Weijiang; Wang, Zhiyuan Synthetic Communications, 2006 , vol. 36, # 19 p. 2851 - 2857 |
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~88%
Benzoic acid, 4... CAS#:94-22-4 |
| Literature: Grynkiewicz, Grzegorz Polish Journal of Chemistry, 1982 , vol. 56, # 1 p. 149 - 152 |
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~%
Benzoic acid, 4... CAS#:94-22-4 |
| Literature: Armstrong; Copenhaver Journal of the American Chemical Society, 1943 , vol. 65, p. 2253 Full Text Show Details Browne; Dyson Journal of the Chemical Society, 1934 , p. 178 Full Text Show Details Matsunaga; Miyajima Molecular crystals and liquid crystals, 1984 , vol. 104, # 3-4 p. 353 - 359 Title/Abstract Full Text View citing articles Show Details Matsunaga, Y.; Sakamoto S.; Togashi, A.; Tsujimoto, M. Molecular Crystals and Liquid Crystals Science and Technology, Section A: Molecular Crystals and Liquid Crystals, 1994 , vol. 250, p. 161 - 166 |
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~%
Benzoic acid, 4... CAS#:94-22-4 |
| Literature: Henstock Journal of the Chemical Society, 1933 , p. 216 |
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Benzoic acid, 4... CAS#:94-22-4 |
| Literature: Tank, Rekha; Pathak, Uma; Vimal, Manorama; Bhattacharyya, Shubhankar; Pandey, Lokesh Kumar Green Chemistry, 2011 , vol. 13, # 12 p. 3350 - 3354 |
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~%
Benzoic acid, 4... CAS#:94-22-4 |
| Literature: Adamson; Kenner Journal of the Chemical Society, 1935 , p. 286,288 Journal of the Chemical Society, 1937 , p. 1554 |
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Detail
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| Literature: Zaki Journal of the Chemical Society, 1928 , p. 983 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 9 | |
|---|---|
| DownStream 1 | |
CAS#:94-12-2This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2916399090 |
|---|---|
| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4-nitrobenzoic acid n-propyl ester |
| n-Propyl p-nitrobenzoate |
| Propyl p-nitrobenzoate |
| 4-Nitro-benzoesaeure-propylester |
| Benzoic acid,4-nitro-,propyl ester |
| propyl-4-nitrobenzoate |
| 4-nitro-benzoic acid propyl ester |
| p-Nitrobenzoic acid,n-propyl ester |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of propyl 4-nitrobenzoate? |
| A: CAS number of propyl 4-nitrobenzoate is 94-22-4. |
| Q: What is the English name of propyl 4-nitrobenzoate? |
| A: The English name of propyl 4-nitrobenzoate is propyl 4-nitrobenzoate. |
| Q: What is the molecular formula of propyl 4-nitrobenzoate? |
| A: Molecular formula of propyl 4-nitrobenzoate is C10H11NO4. |
| Q: What is the polar surface area (PSA) of propyl 4-nitrobenzoate? |
| A: Polar surface area (PSA) of propyl 4-nitrobenzoate is 72.12000. |
| Q: What are the upstream materials of propyl 4-nitrobenzoate? |
| A: Related upstream materials(CAS) of propyl 4-nitrobenzoate: 71-23-8;555-16-8;62-23-7;555-21-5;923-99-9;122-04-3;764-02-3;2315-68-6;7697-37-2. |
| Q: What is the LogP of propyl 4-nitrobenzoate? |
| A: LogP of propyl 4-nitrobenzoate is 2.68480. |
| Q: What are the downstream products of propyl 4-nitrobenzoate? |
| A: Related downstream products(CAS) of propyl 4-nitrobenzoate: 94-12-2. |
| Q: What is the boiling point of propyl 4-nitrobenzoate? |
| A: Boiling point of propyl 4-nitrobenzoate is 328.1ºC at 760 mmHg. |
| Q: What is the Chinese name of 94-22-4? |
| A: Chinese name of 94-22-4 is 94-22-4. |
| Q: What is the SMILES notation of propyl 4-nitrobenzoate? |
| A: SMILES notation of propyl 4-nitrobenzoate is CCCOC(=O)c1ccc([N+](=O)[O-])cc1. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |