3-Nitropentane
3-Nitropentane structure
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Common Name | 3-Nitropentane | ||
|---|---|---|---|---|
| CAS Number | 551-88-2 | Molecular Weight | 117.14600 | |
| Density | 0.943g/cm3 | Boiling Point | 156.3ºC at 760 mmHg | |
| Molecular Formula | C5H11NO2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 46.1ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-Nitropentane |
|---|---|
| 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 | 0.943g/cm3 |
|---|---|
| Boiling Point | 156.3ºC at 760 mmHg |
| Molecular Formula | C5H11NO2 |
| Molecular Weight | 117.14600 |
| Flash Point | 46.1ºC |
| Exact Mass | 117.07900 |
| PSA | 45.82000 |
| LogP | 1.97490 |
| Index of Refraction | 1.416 |
| InChIKey | RXPKOTQRDGEKFY-UHFFFAOYSA-N |
| SMILES | CCC(CC)[N+](=O)[O-] |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2904209090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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3-Nitropentane CAS#:551-88-2 |
| Literature: Moeller, Michael; Hentschel, Carsten; Chi, Lifeng; Studer, Armido Organic and Biomolecular Chemistry, 2011 , vol. 9, # 7 p. 2403 - 2412 |
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3-Nitropentane CAS#:551-88-2 |
| Literature: ANGUS CHEMICAL COMPANY; DOW GLOBAL TECHNOLOGIES INC. Patent: WO2009/129097 A1, 2009 ; Location in patent: Page/Page column 30-31; 33 ; |
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3-Nitropentane CAS#:551-88-2 |
| Literature: Belikov,V.M. et al. Tetrahedron, 1970 , vol. 26, p. 1199 - 1216 |
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3-Nitropentane CAS#:551-88-2 |
| Literature: Belikov,V.M. et al. Tetrahedron, 1970 , vol. 26, p. 1199 - 1216 |
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3-Nitropentane CAS#:551-88-2 |
| Literature: Iffland; Yen Journal of the American Chemical Society, 1954 , vol. 76, p. 4083 |
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3-Nitropentane CAS#:551-88-2 |
| Literature: Bewad Journal fuer Praktische Chemie (Leipzig), 1893 , vol. <2>48, p. 352 |
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3-Nitropentane CAS#:551-88-2 |
| Literature: Bewad Zhurnal Russkago Fiziko-Khimicheskago Obshchestva, 1900 , vol. 32, p. 490 Chem. Zentralbl., 1900 , vol. 71, # II p. 945 |
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3-Nitropentane CAS#:551-88-2 |
| Literature: Bachman,G.B.; Maleski,R.J. Journal of Organic Chemistry, 1972 , vol. 37, # 18 p. 2810 - 2814 |
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3-Nitropentane CAS#:551-88-2
Detail
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| Literature: Baulch, Donald L.; Campbell, Ian M.; Chappel, Jonathan M. Journal of the Chemical Society, Faraday Transactions 1: Physical Chemistry in Condensed Phases, 1984 , vol. 80, p. 617 - 628 |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2904209090 |
|---|---|
| Summary | 2904209090 derivatives containing only nitro or only nitroso groups。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。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: Carcinogenesis bioassays from the Carcinogenic Potency Database (CPDB)
Source: 25294
Target: N/A
External Id: cpdb
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Pentane,3-nitro |
| 3-nitro-pentane |
| 3-Nitropentan |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of 3-Nitropentane? |
| A: Molecular weight of 3-Nitropentane is 117.14600. |
| Q: What is the CAS number of 3-Nitropentane? |
| A: CAS number of 3-Nitropentane is 551-88-2. |
| Q: What is the Chinese name of 551-88-2? |
| A: Chinese name of 551-88-2 is 551-88-2. |
| Q: What English synonyms does 3-Nitropentane have? |
| A: English synonyms of 3-Nitropentane: Pentane,3-nitro, 3-nitro-pentane, 3-Nitropentan. |
| Q: What is the LogP of 3-Nitropentane? |
| A: LogP of 3-Nitropentane is 1.97490. |
| Q: What is the boiling point of 3-Nitropentane? |
| A: Boiling point of 3-Nitropentane is 156.3ºC at 760 mmHg. |
| Q: What is the polar surface area (PSA) of 3-Nitropentane? |
| A: Polar surface area (PSA) of 3-Nitropentane is 45.82000. |
| Q: What is the InChIKey of 3-Nitropentane? |
| A: InChIKey of 3-Nitropentane is RXPKOTQRDGEKFY-UHFFFAOYSA-N. |
| Q: What is the English name of 3-Nitropentane? |
| A: The English name of 3-Nitropentane is 3-Nitropentane. |
| Q: What is the SMILES notation of 3-Nitropentane? |
| A: SMILES notation of 3-Nitropentane is CCC(CC)[N+](=O)[O-]. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |