1-Pyrrolidinecarboxylicacid, methyl ester
1-Pyrrolidinecarboxylicacid, methyl ester structure
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Common Name | 1-Pyrrolidinecarboxylicacid, methyl ester | ||
|---|---|---|---|---|
| CAS Number | 56475-80-0 | Molecular Weight | 129.15700 | |
| Density | 1.1g/cm3 | Boiling Point | 174.4ºC at 760 mmHg | |
| Molecular Formula | C6H11NO2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 59.3ºC | |
Summary: methyl pyrrolidine-1-carboxylate, Chinese name: 吡咯烷甲基氨基甲酸酯, CAS number: 56475-80-0, molecular formula: C6H11NO2, molecular weight: 129.15700, For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | methyl pyrrolidine-1-carboxylate |
|---|---|
| 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 | 1.1g/cm3 |
|---|---|
| Boiling Point | 174.4ºC at 760 mmHg |
| Molecular Formula | C6H11NO2 |
| Molecular Weight | 129.15700 |
| Flash Point | 59.3ºC |
| Exact Mass | 129.07900 |
| PSA | 29.54000 |
| LogP | 0.78650 |
| Index of Refraction | 1.473 |
| InChIKey | UWHWNFVVODLFIQ-UHFFFAOYSA-N |
| SMILES | COC(=O)N1CCCC1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~%
1-Pyrrolidineca... CAS#:56475-80-0 |
| Literature: ABBOTT GMBH and CO. KG Patent: WO2007/118899 A1, 2007 ; Location in patent: Page/Page column 141-142 ; WO 2007/118899 A1 |
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~90%
1-Pyrrolidineca... CAS#:56475-80-0 |
| Literature: Shono, Tatsuya; Matsumura, Yoshihiro; Tsubata, Kenji Journal of the American Chemical Society, 1981 , vol. 103, # 5 p. 1172 - 1176 |
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~%
1-Pyrrolidineca... CAS#:56475-80-0 |
| Literature: Shono, Tatsuya; Terauchi, Jun; Kitayama, Kenji; Takeshima, Yo-Ichiro; Masumura, Yoshihiro Tetrahedron, 1992 , vol. 48, # 38 p. 8253 - 8262 |
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~85%
1-Pyrrolidineca... CAS#:56475-80-0 |
| Literature: Arico, Fabio; Toniolo, Umberto; Tundo, Pietro Green Chemistry, 2012 , vol. 14, # 1 p. 58 - 61 |
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~62%
1-Pyrrolidineca... CAS#:56475-80-0
Learn More
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| Literature: Arico, Fabio; Toniolo, Umberto; Tundo, Pietro Green Chemistry, 2012 , vol. 14, # 1 p. 58 - 61 |
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~%
1-Pyrrolidineca... CAS#:56475-80-0 |
| Literature: Saliu, Francesco; Putomatti, Benedetto; Rindone, Bruno Tetrahedron Letters, 2012 , vol. 53, # 28 p. 3590 - 3593 |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
|
|
Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| methyl 1-pyrrolidinecarboxylate |
| N-methoxycarbonyl-pyrrolidine |
| 1-pyrrolidincarbonsaure-methylester |
| 1-Methoxycarbonyl-pyrrolidine |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of methyl pyrrolidine-1-carboxylate? |
| A: LogP of methyl pyrrolidine-1-carboxylate is 0.78650. |
| Q: What is the boiling point of methyl pyrrolidine-1-carboxylate? |
| A: Boiling point of methyl pyrrolidine-1-carboxylate is 174.4ºC at 760 mmHg. |
| Q: What is the molecular weight of methyl pyrrolidine-1-carboxylate? |
| A: Molecular weight of methyl pyrrolidine-1-carboxylate is 129.15700. |
| Q: What English synonyms does methyl pyrrolidine-1-carboxylate have? |
| A: English synonyms of methyl pyrrolidine-1-carboxylate: methyl 1-pyrrolidinecarboxylate, N-methoxycarbonyl-pyrrolidine, 1-pyrrolidincarbonsaure-methylester, 1-Methoxycarbonyl-pyrrolidine. |
| Q: What is the SMILES notation of methyl pyrrolidine-1-carboxylate? |
| A: SMILES notation of methyl pyrrolidine-1-carboxylate is COC(=O)N1CCCC1. |
| Q: What is the polar surface area (PSA) of methyl pyrrolidine-1-carboxylate? |
| A: Polar surface area (PSA) of methyl pyrrolidine-1-carboxylate is 29.54000. |
| Q: What is the molecular formula of methyl pyrrolidine-1-carboxylate? |
| A: Molecular formula of methyl pyrrolidine-1-carboxylate is C6H11NO2. |
| Q: What is the InChIKey of methyl pyrrolidine-1-carboxylate? |
| A: InChIKey of methyl pyrrolidine-1-carboxylate is UWHWNFVVODLFIQ-UHFFFAOYSA-N. |
| Q: What is the English name of methyl pyrrolidine-1-carboxylate? |
| A: The English name of methyl pyrrolidine-1-carboxylate is methyl pyrrolidine-1-carboxylate. |
| Q: What is the CAS number of methyl pyrrolidine-1-carboxylate? |
| A: CAS number of methyl pyrrolidine-1-carboxylate is 56475-80-0. |
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. |