5-oxo-1-(2-phenylethyl)pyrrolidine-3-carboxylic acid
Modify Date: 2025-08-25 19:14:44
5-oxo-1-(2-phenylethyl)pyrrolidine-3-carboxylic acid structure
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Common Name | 5-oxo-1-(2-phenylethyl)pyrrolidine-3-carboxylic acid | ||
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| CAS Number | 30380-70-2 | Molecular Weight | 233.26300 | |
| Density | N/A | Boiling Point | 471.1ºC at 760 mmHg | |
| Molecular Formula | C13H15NO3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 238.7ºC | |
| Name | 5-oxo-1-(2-phenylethyl)pyrrolidine-3-carboxylic acid |
|---|---|
| Synonym | More Synonyms |
| Boiling Point | 471.1ºC at 760 mmHg |
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| Molecular Formula | C13H15NO3 |
| Molecular Weight | 233.26300 |
| Flash Point | 238.7ºC |
| Exact Mass | 233.10500 |
| PSA | 57.61000 |
| LogP | 1.10010 |
| InChIKey | WXPXDXDHJYRETJ-UHFFFAOYSA-N |
| SMILES | O=C(O)C1CC(=O)N(CCc2ccccc2)C1 |
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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| HS Code | 2933990090 |
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~99%
5-oxo-1-(2-phen... CAS#:30380-70-2 |
| Literature: Dou, Dengfeng; He, Guijia; Mandadapu, Sivakoteswara Rao; Aravapalli, Sridhar; Kim, Yunjeong; Chang, Kyeong-Ok; Groutas, William C. Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 1 p. 377 - 379 |
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~%
5-oxo-1-(2-phen... CAS#:30380-70-2 |
| Literature: Dou, Dengfeng; He, Guijia; Mandadapu, Sivakoteswara Rao; Aravapalli, Sridhar; Kim, Yunjeong; Chang, Kyeong-Ok; Groutas, William C. Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 1 p. 377 - 379 |
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~%
5-oxo-1-(2-phen... CAS#:30380-70-2 |
| Literature: Dou, Dengfeng; He, Guijia; Mandadapu, Sivakoteswara Rao; Aravapalli, Sridhar; Kim, Yunjeong; Chang, Kyeong-Ok; Groutas, William C. Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 1 p. 377 - 379 |
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~58%
5-oxo-1-(2-phen... CAS#:30380-70-2 |
| Literature: Takeda Chemical Industries, Ltd. Patent: EP1180513 A1, 2002 ; Location in patent: Referential example 47 ; EP 1180513 A1 |
| HS Code | 2933990090 |
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| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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|
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
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Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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|
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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|
Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
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| (+-)-1-Phenethyl-5-oxo-pyrrolidin-3-carbonsaeure |
| 3-Pyrrolidinecarboxylic acid,5-oxo-1-(2-phenylethyl) |
| 5-Oxo-1-(2-phenylethyl)-3-pyrrolidinecarboxylic acid |
| 5-oxo-1-phenethyl-pyrrolidine-3-carboxylic acid |
| 5-oxo-1-phenethyl-3-pyrrolidinecarboxylic acid |
| 5-Oxo-1-phenaethyl-pyrrolidin-3-carbonsaeure |