≥98% 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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488186523 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488186523 |
| 정식 스마일 | CC(C)(C)OC(=O)N1CC(CC1C(=O)O)O |
| IUPAC Name | (2S,4R)-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid |
| InChIKey | BENKAPCDIOILGV-RQJHMYQMSA-N |
| INCHI | 1S/C10H17NO5/c1-10(2,3)16-9(15)11-5-6(12)4-7(11)8(13)14/h6-7,12H,4-5H2,1-3H3,(H,13,14)/t6-,7+/m1/s1 |
| 이성체 SMILES | CC(C)(C)OC(=O)N1C[C@@H](C[C@H]1C(=O)O)O |
| WGK 독일 | 3 |
| 분자량 | 231.25 |
| Beilstein | 4295484 |
| Reaxy-Rn | 406671 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=406671&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 | Organic acids and derivatives |
| 분류 | Carboxylic acids and derivatives |
| Subclass | Amino acids, peptides, and analogues |
| Intermediate Tree Nodes | Amino acids and derivatives - Alpha amino acids and derivatives |
| Direct Parent | Proline and derivatives |
| Alternative Parents | Pyrrolidine carboxylic acids Carbamate esters Secondary alcohols Organic carbonic acids and derivatives Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | Proline or derivatives - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine - Carbamic acid ester - Carbonic acid derivative - Secondary alcohol - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid - Azacycle - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Aliphatic heteromonocyclic compound |
| 설명 | This compound belongs to the class of organic compounds known as proline and derivatives. These are compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | 날짜 | 항목 |
|---|---|---|---|
 B2208326 | Certificate of Analysis | Oct 30, 2025 | B111006 |
| B2208327 | Certificate of Analysis | Oct 30, 2025 | B111006 |
| B2208328 | Certificate of Analysis | Oct 30, 2025 | B111006 |
| B2208338 | Certificate of Analysis | Oct 30, 2025 | B111006 |
| A2213019 | Certificate of Analysis | Oct 13, 2025 | B111006 |
| G1904173 | Certificate of Analysis | Apr 17, 2023 | B111006 |
| I1814003 | Certificate of Analysis | Jul 19, 2022 | B111006 |
| E2325136 | Certificate of Analysis | Jan 15, 2022 | B111006 |
| E2325141 | Certificate of Analysis | Jan 05, 2022 | B111006 |
| E2325145 | Certificate of Analysis | Jan 05, 2022 | B111006 |
| I2319063 | Certificate of Analysis | Jan 05, 2022 | B111006 |
| 용해성 | Solubility in Water very faint turbidity |
|---|---|
| 특정 회전[α] | -68 ° (C=1, MeOH) |
| 녹는점(°C) | 123-127 °C |
| 분자량 | 231.250 g/mol |
| XLogP3 | 0.300 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 231.111 Da |
| Monoisotopic Mass | 231.111 Da |
| Topological Polar Surface Area | 87.100 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 296.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| 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 |
| 1. Jing Huang, Zhuo Yao, Bowen Li, Yuan Ping. (2023) Targeted delivery of PROTAC-based prodrug activated by bond-cleavage bioorthogonal chemistry for microneedle-assisted cancer therapy. JOURNAL OF CONTROLLED RELEASE, [PMID:37541594] [10.1016/j.jconrel.2023.07.062] |
| 2. Jiahe Huang, Chunhong Zhang, Jianwei Bai, Yudan Wang, Toshifumi Satoh, Feng-Huei Lin. (2025) Self-Assembled Supramolecular Gels for Catalyzing Asymmetric Aldol and Mannich Reactions in Aqueous Media. ACS Sustainable Chemistry & Engineering, [PMID:] [10.1021/acssuschemeng.5c00078] |
