≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Used in a synthesis of ?-aryl-GABA analogues by Heck arylation with arenediazonium salts. Used to synthesize aryl pyrrolizidines.
| Pubchem Sid | 488195113 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488195113 |
| Canonical Smiles | CC(C)(C)OC(=O)N1CC=CC1 |
| IUPAC Name | tert-butyl 2,5-dihydropyrrole-1-carboxylate |
| InChIKey | YEBDZDMYLQHGGZ-UHFFFAOYSA-N |
| INCHI | 1S/C9H15NO2/c1-9(2,3)12-8(11)10-6-4-5-7-10/h4-5H,6-7H2,1-3H3 |
| Isomeric SMILES | CC(C)(C)OC(=O)N1CC=CC1 |
| WGK Germany | 3 |
| Molecular Weight | 169.22 |
| Reaxy-Rn | 4388594 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4388594&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Pyrrolines |
| Subclass | Pyrroline carboxylic acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Pyrroline carboxylic acids |
| Alternative Parents | Carbamate esters Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | Pyrroline carboxylic acid - Carbamic acid ester - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as pyrroline carboxylic acids. These are heterocyclic compounds containing a pyrroline ring substituted by one or more carboxylic acid groups. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 C1406079 | Certificate of Analysis | Jan 27, 2026 | B121972 |
| C1406080 | Certificate of Analysis | Jan 05, 2026 | B121972 |
| B2322361 | Certificate of Analysis | Jan 29, 2023 | B121972 |
| B2322362 | Certificate of Analysis | Jan 29, 2023 | B121972 |
| B2322365 | Certificate of Analysis | Jan 29, 2023 | B121972 |
| B2322372 | Certificate of Analysis | Jan 29, 2023 | B121972 |
| B2322541 | Certificate of Analysis | Jan 29, 2023 | B121972 |
| Solubility | Soluble in Methanol |
|---|---|
| Sensitivity | Air Sensitive,Moisture Sensitive |
| Refractive Index | 1.458 |
| Flash Point(°F) | 177.8 °F |
| Flash Point(°C) | 81°C(178°F) |
| Boil Point(°C) | 208°C |
| Melt Point(°C) | 41 °C |
| Molecular Weight | 169.220 g/mol |
| XLogP3 | 1.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 169.11 Da |
| Monoisotopic Mass | 169.11 Da |
| Topological Polar Surface Area | 29.500 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 195.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
