1,4-Bis(2-carboxyethyl)piperazine
1,4-Bis(2-carboxyethyl)piperazine structure
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Common Name | 1,4-Bis(2-carboxyethyl)piperazine | ||
|---|---|---|---|---|
| CAS Number | 5649-49-0 | Molecular Weight | 230.26100 | |
| Density | 1.238g/cm3 | Boiling Point | 458.1ºC at 760mmHg | |
| Molecular Formula | C10H18N2O4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 230.8ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 1,4-Bis(2-carboxyethyl)piperazine |
|---|---|
| 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 | 1.238g/cm3 |
|---|---|
| Boiling Point | 458.1ºC at 760mmHg |
| Molecular Formula | C10H18N2O4 |
| Molecular Weight | 230.26100 |
| Flash Point | 230.8ºC |
| Exact Mass | 230.12700 |
| PSA | 81.08000 |
| Index of Refraction | 1.52 |
| InChIKey | WCJNJOOLQWJKLU-UHFFFAOYSA-N |
| SMILES | O=C(O)CCN1CCN(CCC(=O)O)CC1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xn |
|---|---|
| Risk Phrases | 36/37/38 |
| Safety Phrases | 26-36/37/39 |
| HS Code | 2933599090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~75%
1,4-Bis(2-carbo... CAS#:5649-49-0 |
| Literature: Saupe, Sebastian M.; Leubner, Stephanie; Betz, Michael; Klebe, Gerhard; Steinmetzer, Torsten Journal of Medicinal Chemistry, 2013 , vol. 56, # 3 p. 820 - 831 |
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~%
1,4-Bis(2-carbo... CAS#:5649-49-0 |
| Literature: Mracec, Maria; Safta, Marius; Wikete, Cornelia; Mracec, Mircea; Costisor, Otilia Revue Roumaine de Chimie, 2001 , vol. 46, # 7 p. 779 - 786 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933599090 |
|---|---|
| Summary | 2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring 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: qHTS assay for inhibitors of human lactate dehydrogenase
Source: NCGC
Target: N/A
External Id: LDHA
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Name: Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
Source: NCGC
External Id: stopgo-p2-SytraCBC-dual-FF
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Name: Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
Source: NCGC
External Id: stopgo-p2-SytraCBC-dual-Ren
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-[4-(2-carboxyethyl)piperazin-1-yl]propanoic acid |
| EINECS 227-088-5 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the safety information for 1,4-Bis(2-carboxyethyl)piperazine? |
| A: Safety information for 1,4-Bis(2-carboxyethyl)piperazine: 26-36/37/39. |
| Q: What English synonyms does 1,4-Bis(2-carboxyethyl)piperazine have? |
| A: English synonyms of 1,4-Bis(2-carboxyethyl)piperazine: 3-[4-(2-carboxyethyl)piperazin-1-yl]propanoic acid, EINECS 227-088-5. |
| Q: What is the boiling point of 1,4-Bis(2-carboxyethyl)piperazine? |
| A: Boiling point of 1,4-Bis(2-carboxyethyl)piperazine is 458.1ºC at 760mmHg. |
| Q: What is the molecular formula of 1,4-Bis(2-carboxyethyl)piperazine? |
| A: Molecular formula of 1,4-Bis(2-carboxyethyl)piperazine is C10H18N2O4. |
| Q: What is the InChIKey of 1,4-Bis(2-carboxyethyl)piperazine? |
| A: InChIKey of 1,4-Bis(2-carboxyethyl)piperazine is WCJNJOOLQWJKLU-UHFFFAOYSA-N. |
| Q: What is the English name of 1,4-Bis(2-carboxyethyl)piperazine? |
| A: The English name of 1,4-Bis(2-carboxyethyl)piperazine is 1,4-Bis(2-carboxyethyl)piperazine. |
| Q: What is the SMILES notation of 1,4-Bis(2-carboxyethyl)piperazine? |
| A: SMILES notation of 1,4-Bis(2-carboxyethyl)piperazine is O=C(O)CCN1CCN(CCC(=O)O)CC1. |
| Q: What is the polar surface area (PSA) of 1,4-Bis(2-carboxyethyl)piperazine? |
| A: Polar surface area (PSA) of 1,4-Bis(2-carboxyethyl)piperazine is 81.08000. |
| Q: What is the CAS number of 1,4-Bis(2-carboxyethyl)piperazine? |
| A: CAS number of 1,4-Bis(2-carboxyethyl)piperazine is 5649-49-0. |
| Q: What are the upstream materials of 1,4-Bis(2-carboxyethyl)piperazine? |
| A: Related upstream materials(CAS) of 1,4-Bis(2-carboxyethyl)piperazine: 590-92-1;142-63-2;110-85-0;50-00-0;141-82-2. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |