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Basic Description
| Synonyms | SB11645 | 3-Pyrrolidinecarboxylic acid, 5-oxo- | AKOS025146459 | 5-0xopyrrolidine-3-carboxylic acid | EN300-59487 | MFCD13194688 | AKOS016042673 | P10333 | A866222 | AKOS000140611 | SY042553 | 5-oxopyrrolidine-3-carboxylicacid | NCGC00338437-01 | SY343985 |
|---|---|
| Specifications & Purity | ≥97% |
| Storage Temp | Room temperature |
| Shipped In | Normal |
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Pyrrolidones
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Pyrrolidines |
| Subclass | Pyrrolidones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Oxoprolines |
| Alternative Parents | Pyrrolidine carboxylic acids Pyrrolidine-2-ones Secondary carboxylic acid amides Lactams Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | Oxoproline - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - 2-pyrrolidone - Carboxamide group - Lactam - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Aliphatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as oxoprolines. These are compounds containing an oxoproline moiety, which consists of a pyrrolidine ring bearing a carboxylic acid group at the ring position 2, and a ketone group. |
| External Descriptors | Not available |
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Names and Identifiers
| Pubchem Sid | 488199446 |
|---|---|
| IUPAC Name | 5-oxopyrrolidine-3-carboxylic acid |
| INCHI | InChI=1S/C5H7NO3/c7-4-1-3(2-6-4)5(8)9/h3H,1-2H2,(H,6,7)(H,8,9) |
| InChIKey | GZVHQYZRBCSHAI-UHFFFAOYSA-N |
| Smiles | C1C(CNC1=O)C(=O)O |
| Isomeric SMILES | C1C(CNC1=O)C(=O)O |
| Molecular Weight | 129.11 |
| Reaxy-Rn | 387596 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=387596&ln= |
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 H2323701 |
Certificate of Analysis | Aug 07, 2023 | O177293 |
| H2323705 |
Certificate of Analysis | Aug 07, 2023 | O177293 |
| H2323710 |
Certificate of Analysis | Aug 07, 2023 | O177293 |
| H2323687 |
Certificate of Analysis | Aug 07, 2023 | O177293 |
| H2323691 |
Certificate of Analysis | Aug 07, 2023 | O177293 |
| H2323716 |
Certificate of Analysis | Aug 07, 2023 | O177293 |
Chemical and Physical Properties
| Molecular Weight | 129.110 g/mol |
|---|---|
| XLogP3 | -1.200 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 129.043 Da |
| Monoisotopic Mass | 129.043 Da |
| Topological Polar Surface Area | 66.400 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 154.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
Solution Calculators
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