3H-Pyrazol-3-one,5-amino-2,4-dihydro-2-phenyl structure
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Common Name | 3H-Pyrazol-3-one,5-amino-2,4-dihydro-2-phenyl | ||
|---|---|---|---|---|
| CAS Number | 4149-06-8 | Molecular Weight | 175.18700 | |
| Density | 1.34g/cm3 | Boiling Point | 312.3ºC at 760mmHg | |
| Molecular Formula | C9H9N3O | Melting Point | 210-215 °C (dec.)(lit.) | |
| MSDS | N/A | Flash Point | 142.7ºC | |
| Name | 3-Amino-1-phenyl-2-pyrazolin-5-one |
|---|---|
| Synonym | More Synonyms |
| Density | 1.34g/cm3 |
|---|---|
| Boiling Point | 312.3ºC at 760mmHg |
| Melting Point | 210-215 °C (dec.)(lit.) |
| Molecular Formula | C9H9N3O |
| Molecular Weight | 175.18700 |
| Flash Point | 142.7ºC |
| Exact Mass | 175.07500 |
| PSA | 58.69000 |
| LogP | 0.89640 |
| InChIKey | LPOVZHYARSAVIZ-UHFFFAOYSA-N |
| SMILES | NC1=NN(c2ccccc2)C(=O)C1 |
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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| Hazard Codes | Xi: Irritant; |
|---|---|
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S37/39 |
| WGK Germany | 3 |
| RTECS | UR0393500 |
| HS Code | 2933199090 |
|
~75%
3H-Pyrazol-3-on... CAS#:4149-06-8 |
| Literature: Hyatt, John A.; Maggiulli, Cataldo A.; French, Stephen E. Journal of Heterocyclic Chemistry, 1983 , vol. 20, p. 773 - 774 |
|
~73%
3H-Pyrazol-3-on... CAS#:4149-06-8 |
| Literature: Kim, Chang-Kyu; Zielinski, Paul A.; Maggiulli, Cataldo A. Journal of Organic Chemistry, 1984 , vol. 49, # 26 p. 5247 - 5250 |
|
~%
3H-Pyrazol-3-on... CAS#:4149-06-8 |
| Literature: Journal of Heterocyclic Chemistry, , vol. 20, p. 773 - 774 |
|
~%
3H-Pyrazol-3-on... CAS#:4149-06-8 |
| Literature: Journal of Organic Chemistry, , vol. 49, # 26 p. 5247 - 5250 |
|
~%
3H-Pyrazol-3-on... CAS#:4149-06-8 |
| Literature: Journal of Organic Chemistry, , vol. 49, # 26 p. 5247 - 5250 |
|
~%
3H-Pyrazol-3-on... CAS#:4149-06-8 |
| Literature: Journal of Organic Chemistry, , vol. 49, # 26 p. 5247 - 5250 |
|
~%
3H-Pyrazol-3-on... CAS#:4149-06-8 |
| Literature: Journal fuer Praktische Chemie (Leipzig), , vol. 327, # 2 p. 209 - 219 |
| HS Code | 2933199090 |
|---|---|
| Summary | 2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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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: 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: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_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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Name: uHTS identification of small molecule modulators of NR3A
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1015-NR3A-Primary-Assay
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Name: uHTS identification of small molecule modulators of Rev-erb Alpha.
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1016-RevErbaLBD-Primary-Assay
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Name: MITF Measured in Cell-Based System Using Plate Reader - 2084-01_Activator_SinglePoint...
Source: Broad Institute
Target: N/A
External Id: 2084-01_Activator_SinglePoint_HTS_Activity
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| 3-Amino-1-phenyl-1H-pyrazol-5(4H)-one |
| 5-Amino-2-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| MFCD00003137 |
| EINECS 223-974-0 |