4,6-Dimethoxy-1H-indole
4,6-Dimethoxy-1H-indole structure
|
Common Name | 4,6-Dimethoxy-1H-indole | ||
|---|---|---|---|---|
| CAS Number | 23659-87-2 | Molecular Weight | 177.200 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 343.8±22.0 °C at 760 mmHg | |
| Molecular Formula | C10H11NO2 | Melting Point | 122-124ºC | |
| MSDS | Chinese USA | Flash Point | 125.7±12.6 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4,6-dimethoxy-1H-indole |
|---|---|
| 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 | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 343.8±22.0 °C at 760 mmHg |
| Melting Point | 122-124ºC |
| Molecular Formula | C10H11NO2 |
| Molecular Weight | 177.200 |
| Flash Point | 125.7±12.6 °C |
| Exact Mass | 177.078979 |
| PSA | 34.25000 |
| LogP | 1.79 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.609 |
| InChIKey | NRQBTNARWALYSB-UHFFFAOYSA-N |
| SMILES | COc1cc(OC)c2cc[nH]c2c1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26 |
| RIDADR | NONH for all modes of transport |
| HS Code | 2933990090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~23%
4,6-Dimethoxy-1... CAS#:23659-87-2
Learn More
|
| Literature: Tetrahedron Letters, , vol. 21, p. 1883 - 1886 |
|
~94%
4,6-Dimethoxy-1... CAS#:23659-87-2 |
| Literature: Hall, Robin J.; Jackson, Anthony H.; Shannon, Patrick V. R.; Oliveira-Campos, Ana M. F. Journal of Chemical Research, Miniprint, 1990 , # 10 p. 2501 - 2519 |
|
~47%
4,6-Dimethoxy-1... CAS#:23659-87-2 |
| Literature: Jumina; Kumar, Naresh; Black, David St.C. Tetrahedron, 2009 , vol. 65, # 12 p. 2591 - 2598 |
|
~49%
4,6-Dimethoxy-1... CAS#:23659-87-2 |
| Literature: Black, David St.C.; Kumar, Naresh; Wong, Laurence C. H. Australian Journal of Chemistry, 1986 , vol. 39, p. 15 - 20 |
|
~%
4,6-Dimethoxy-1... CAS#:23659-87-2 |
| Literature: Tetrahedron Letters, , vol. 21, p. 1883 - 1886 |
|
~81%
4,6-Dimethoxy-1... CAS#:23659-87-2 |
| Literature: Bratulescu, George Tetrahedron Letters, 2008 , vol. 49, # 6 p. 984 - 986 |
|
~19%
4,6-Dimethoxy-1... CAS#:23659-87-2 |
| Literature: Hall, Robin J.; Jackson, Anthony H.; Shannon, Patrick V. R.; Oliveira-Campos, Ana M. F. Journal of Chemical Research, Miniprint, 1990 , # 10 p. 2501 - 2519 |
|
~%
4,6-Dimethoxy-1... CAS#:23659-87-2 |
| Literature: Journal of Chemical Research, Miniprint, , # 10 p. 2501 - 2519 |
|
~%
4,6-Dimethoxy-1... CAS#:23659-87-2 |
| Literature: Journal of Chemical Research, Miniprint, , # 10 p. 2501 - 2519 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 7 | |
|---|---|
| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933990090 |
|---|---|
| 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% |
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
|
|
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
|
|
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
|
|
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
|
|
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
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4,6-Dimethoxy-indol |
| 4,6-Dimethoxy-1H-indole |
| 4,6-dimethoxyindole |
| 1H-Indole,4,6-dimethoxy |
| MFCD00128213 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the boiling point of 4,6-dimethoxy-1H-indole? |
| A: Boiling point of 4,6-dimethoxy-1H-indole is 343.8±22.0 °C at 760 mmHg. |
| Q: What are the upstream materials of 4,6-dimethoxy-1H-indole? |
| A: Related upstream materials(CAS) of 4,6-dimethoxy-1H-indole: 23659-85-0;21544-81-0;105776-11-2;10272-07-8;96406-93-8;127-17-3;132257-00-2. |
| Q: What is the English name of 4,6-dimethoxy-1H-indole? |
| A: The English name of 4,6-dimethoxy-1H-indole is 4,6-dimethoxy-1H-indole. |
| Q: What is the SMILES notation of 4,6-dimethoxy-1H-indole? |
| A: SMILES notation of 4,6-dimethoxy-1H-indole is COc1cc(OC)c2cc[nH]c2c1. |
| Q: What is the polar surface area (PSA) of 4,6-dimethoxy-1H-indole? |
| A: Polar surface area (PSA) of 4,6-dimethoxy-1H-indole is 34.25000. |
| Q: What is the LogP of 4,6-dimethoxy-1H-indole? |
| A: LogP of 4,6-dimethoxy-1H-indole is 1.79. |
| Q: What is the safety information for 4,6-dimethoxy-1H-indole? |
| A: Safety information for 4,6-dimethoxy-1H-indole: S26. |
| Q: What is the InChIKey of 4,6-dimethoxy-1H-indole? |
| A: InChIKey of 4,6-dimethoxy-1H-indole is NRQBTNARWALYSB-UHFFFAOYSA-N. |
| Q: What is the CAS number of 4,6-dimethoxy-1H-indole? |
| A: CAS number of 4,6-dimethoxy-1H-indole is 23659-87-2. |
| Q: What is the molecular formula of 4,6-dimethoxy-1H-indole? |
| A: Molecular formula of 4,6-dimethoxy-1H-indole is C10H11NO2. |
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. |