6-Chlorobenzo[D]Isoxazol-3-Ol
![6-Chlorobenzo[D]Isoxazol-3-Ol Structure](https://image.chemsrc.com/caspic/066/61977-29-5.png)
6-Chlorobenzo[D]Isoxazol-3-Ol structure
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Common Name | 6-Chlorobenzo[D]Isoxazol-3-Ol | ||
|---|---|---|---|---|
| CAS Number | 61977-29-5 | Molecular Weight | 169.565 | |
| Density | 1.5±0.1 g/cm3 | Boiling Point | 336.7±22.0 °C at 760 mmHg | |
| Molecular Formula | C7H4ClNO2 | Melting Point | 218-220ºC | |
| MSDS | Chinese USA | Flash Point | 157.4±22.3 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Use of 6-Chlorobenzo[D]Isoxazol-3-OlCBIO is a potent, cell-permeable, D-amino acid oxidase (DAO) reversible inhibitor. In rat models, CBIO prevents formalin-induced tonic pain but not acute nociception. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 6-Chlorobenzo[d]isoxazol-3-ol |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.5±0.1 g/cm3 |
|---|---|
| Boiling Point | 336.7±22.0 °C at 760 mmHg |
| Melting Point | 218-220ºC |
| Molecular Formula | C7H4ClNO2 |
| Molecular Weight | 169.565 |
| Flash Point | 157.4±22.3 °C |
| Exact Mass | 168.993057 |
| PSA | 46.26000 |
| LogP | 1.49 |
| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
| Index of Refraction | 1.674 |
| InChIKey | SJAPSPJRTQCDNO-UHFFFAOYSA-N |
| SMILES | O=c1[nH]oc2cc(Cl)ccc12 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302 |
| Hazard Codes | Xi |
| Risk Phrases | R36/37/38 |
| Safety Phrases | 26-36/37/39 |
| RIDADR | NONH for all modes of transport |
| HS Code | 2934999090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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6-Chlorobenzo[D... CAS#:61977-29-5 |
| Literature: Jiangsu Guohua Investment Co., Ltd; Shanghai Institute of Pharmaceutical Industry Patent: EP2322520 A1, 2011 ; Location in patent: Page/Page column 12 ; |
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6-Chlorobenzo[D... CAS#:61977-29-5 |
| Literature: US5484763 A1, ; |
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6-Chlorobenzo[D... CAS#:61977-29-5 |
| Literature: EP2322520 A1, ; |
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6-Chlorobenzo[D... CAS#:61977-29-5 |
| Literature: EP2322520 A1, ; |
![(5,6-DIMETHYL-4-OXO-3,4-DIHYDRO-THIENO[2,3-D]PYRIMIDIN-2-YL)-ACETICACIDMETHYLESTER structure](https://image.chemsrc.com/caspic/353/61799-78-8.png)
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 1 | |
![3,6-Dichlorobenzo[d]isoxazole structure](https://image.chemsrc.com/caspic/189/16263-54-0.png)
CAS#:16263-54-0This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Salmonella evades D-amino acid oxidase to promote infection in neutrophils.
MBio 5(6) , e01886, (2014) Neutrophils engulf and kill bacteria using oxidative and nonoxidative mechanisms. Despite robust antimicrobial activity, neutrophils are impaired in directing Salmonella clearance and harbor viable in... |
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Contributions of spinal D-amino acid oxidase to chronic morphine-induced hyperalgesia.
J. Pharm. Biomed. Anal. 116 , 131-8, (2015) Spinal D-amino acid oxidase (DAAO) is an FAD-dependent peroxisomal flavoenzyme which mediates the conversion of neutral and polar D-amino acids (including D-serine) to the corresponding α-keto acids, ... |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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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: 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: 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: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
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Name: A screen for small molecules that modulate mitochondrial supercomplex formation
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: N/A
External Id: HMS1482
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 6-Chloro-1,2-benzoxazol-3(2H)-one |
| 6-chloro-1,2-benzoxazol-3-one |
| 6-Chlorobenzo[D]Isoxazol-3-Ol |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What English synonyms does 6-Chlorobenzo[d]isoxazol-3-ol have? |
| A: English synonyms of 6-Chlorobenzo[d]isoxazol-3-ol: 6-Chloro-1,2-benzoxazol-3(2H)-one, 6-chloro-1,2-benzoxazol-3-one, 6-Chlorobenzo[D]Isoxazol-3-Ol. |
| Q: What are the uses of 6-Chlorobenzo[d]isoxazol-3-ol? |
| A: Main uses of 6-Chlorobenzo[d]isoxazol-3-ol: CBIO is a potent, cell-permeable, D-amino acid oxidase (DAO) reversible inhibitor. In rat models, CBIO prevents formalin-induced tonic pain but not acute nociception. |
| Q: What is the SMILES notation of 6-Chlorobenzo[d]isoxazol-3-ol? |
| A: SMILES notation of 6-Chlorobenzo[d]isoxazol-3-ol is O=c1[nH]oc2cc(Cl)ccc12. |
| Q: What is the melting point of 6-Chlorobenzo[d]isoxazol-3-ol? |
| A: Melting point of 6-Chlorobenzo[d]isoxazol-3-ol is 218-220ºC. |
| Q: What is the molecular formula of 6-Chlorobenzo[d]isoxazol-3-ol? |
| A: Molecular formula of 6-Chlorobenzo[d]isoxazol-3-ol is C7H4ClNO2. |
| Q: What is the CAS number of 6-Chlorobenzo[d]isoxazol-3-ol? |
| A: CAS number of 6-Chlorobenzo[d]isoxazol-3-ol is 61977-29-5. |
| Q: What is the boiling point of 6-Chlorobenzo[d]isoxazol-3-ol? |
| A: Boiling point of 6-Chlorobenzo[d]isoxazol-3-ol is 336.7±22.0 °C at 760 mmHg. |
| Q: What is the InChIKey of 6-Chlorobenzo[d]isoxazol-3-ol? |
| A: InChIKey of 6-Chlorobenzo[d]isoxazol-3-ol is SJAPSPJRTQCDNO-UHFFFAOYSA-N. |
| Q: What is the safety information for 6-Chlorobenzo[d]isoxazol-3-ol? |
| A: Safety information for 6-Chlorobenzo[d]isoxazol-3-ol: 26-36/37/39. |
| Q: What is the molecular weight of 6-Chlorobenzo[d]isoxazol-3-ol? |
| A: Molecular weight of 6-Chlorobenzo[d]isoxazol-3-ol is 169.565. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |