6-Methyl-2,3,4,9-tetrahydro-carbazol-1-one
6-Methyl-2,3,4,9-tetrahydro-carbazol-1-one structure
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Common Name | 6-Methyl-2,3,4,9-tetrahydro-carbazol-1-one | ||
|---|---|---|---|---|
| CAS Number | 3449-48-7 | Molecular Weight | 199.248 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 396.7±11.0 °C at 760 mmHg | |
| Molecular Formula | C13H13NO | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 200.5±26.7 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one |
|---|---|
| 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 | 396.7±11.0 °C at 760 mmHg |
| Molecular Formula | C13H13NO |
| Molecular Weight | 199.248 |
| Flash Point | 200.5±26.7 °C |
| Exact Mass | 199.099716 |
| PSA | 32.86000 |
| LogP | 3.00 |
| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
| Index of Refraction | 1.669 |
| InChIKey | ITWUGZSJDMBOPH-UHFFFAOYSA-N |
| SMILES | Cc1ccc2[nH]c3c(c2c1)CCCC3=O |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933990090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~91%
6-Methyl-2,3,4,... CAS#:3449-48-7 |
| Literature: Sheng, Rong; Shen, Li; Chen, You-Qin; Hu, Yong-Zhou Synthetic Communications, 2009 , vol. 39, # 6 p. 1120 - 1127 |
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~%
6-Methyl-2,3,4,... CAS#:3449-48-7 |
| Literature: Gudmundsson, Kristjan Patent: US2009/170923 A1, 2009 ; |
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~37%
6-Methyl-2,3,4,... CAS#:3449-48-7 |
| Literature: Zhao, Liyun; Mullen, Kathleen M; Chmielewski, Michal J.; Brown, Asha; Bampos, Nick; Beer, Paul D.; Davis, Jason J. New Journal of Chemistry, 2009 , vol. 33, # 4 p. 760 - 768 |
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~67%
6-Methyl-2,3,4,... CAS#:3449-48-7 |
| Literature: Gazengel; Lancelot; Rault; Robba Journal of Heterocyclic Chemistry, 1990 , vol. 27, # 7 p. 1947 - 1951 |
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~%
6-Methyl-2,3,4,... CAS#:3449-48-7 |
| Literature: Chakraborty, Suchandra; Chattopadhyay, Gautam; Saha, Chandan Journal of Heterocyclic Chemistry, 2011 , vol. 48, # 2 p. 331 - 338 |
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~%
6-Methyl-2,3,4,... CAS#:3449-48-7 |
| Literature: Shi, Hao; Guo, Tianjian; Zhang-Negrerie, Daisy; Du, Yunfei; Zhao, Kang Tetrahedron, 2014 , vol. 70, # 17 p. 2753 - 2760 |
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~%
6-Methyl-2,3,4,... CAS#:3449-48-7 |
| Literature: Bloink; Pausacker Journal of the Chemical Society, 1950 , p. 1328,1330 |
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~%
6-Methyl-2,3,4,... CAS#:3449-48-7
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| Literature: Martin, Arputharaj Ebenezer; Prasad, Karnam Jayarampillai Rajendra Journal of Chemical Research, 2007 , # 11 p. 653 - 656 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 7 | |
![8-methyl-11H-pyrano[2,3-a]carbazol-2-one structure](https://image.chemsrc.com/caspic/287/248246-35-7.png)
CAS#:248246-35-7![2-[(6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl)amino]ethanol structure](https://image.chemsrc.com/caspic/380/118499-01-7.png)
CAS#:118499-01-7
CAS#:121593-92-8
CAS#:118498-98-9
CAS#:118498-97-8
CAS#:16154-78-2
CAS#:4630-20-0This 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
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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: 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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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 6-methyl-1,2,3,4-tetrahydrocarbazol-1-one |
| 6-Methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one |
| 6-methyl-2,3,4,9-tetrahydro-carbazol-1-one |
| 1-keto-1,2,3,4-tetrahydro-6-methylcarbazole |
| 6-methyl-1-oxo-2,3,4,9-tetrahydrocarbazole |
| 1,2,3,4-tetrahydro-6-methylcarbazol-1-one |
| 6-methyl-1-oxo-1,2,3,4-tetrahydrocarbazole |
| 1H-Carbazol-1-one,2,3,4,9-tetrahydro-6-methyl |
| 6-methyl-2,3,4,9-tetrahydro-4aH-carbazol-1-one |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one? |
| A: Polar surface area (PSA) of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one is 32.86000. |
| Q: What English synonyms does 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one have? |
| A: English synonyms of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one: 6-methyl-1,2,3,4-tetrahydrocarbazol-1-one, 6-Methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one, 6-methyl-2,3,4,9-tetrahydro-carbazol-1-one, 1-keto-1,2,3,4-tetrahydro-6-methylcarbazole, 6-methyl-1-oxo-2,3,4,9-tetrahydrocarbazole, 1,2,3,4-tetrahydro-6-methylcarbazol-1-one, 6-methyl-1-oxo-1,2,3,4-tetrahydrocarbazole, 1H-Carbazol-1-one,2,3,4,9-tetrahydro-6-methyl, 6-methyl-2,3,4,9-tetrahydro-4aH-carbazol-1-one. |
| Q: What is the InChIKey of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one? |
| A: InChIKey of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one is ITWUGZSJDMBOPH-UHFFFAOYSA-N. |
| Q: What are the downstream products of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one? |
| A: Related downstream products(CAS) of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one: 248246-35-7;118499-01-7;121593-92-8;118498-98-9;118498-97-8;16154-78-2;4630-20-0. |
| Q: What is the LogP of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one? |
| A: LogP of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one is 3.00. |
| Q: What is the molecular weight of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one? |
| A: Molecular weight of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one is 199.248. |
| Q: What is the English name of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one? |
| A: The English name of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one is 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one. |
| Q: What is the molecular formula of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one? |
| A: Molecular formula of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one is C13H13NO. |
| Q: What is the SMILES notation of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one? |
| A: SMILES notation of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one is Cc1ccc2[nH]c3c(c2c1)CCCC3=O. |
| Q: What are the upstream materials of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one? |
| A: Related upstream materials(CAS) of 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one: 637-60-5;6946-05-0;39695-64-2;106-49-0;765-87-7;2257-17-2;2028-84-4;823-45-0;23740-64-9;533-60-8. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |