4,5,6,7-Tetrahydro-1h-indole-2-carboxylicacid
4,5,6,7-Tetrahydro-1h-indole-2-carboxylicacid structure
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Common Name | 4,5,6,7-Tetrahydro-1h-indole-2-carboxylicacid | ||
|---|---|---|---|---|
| CAS Number | 131172-64-0 | Molecular Weight | 165.18900 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C9H11NO2 | Melting Point | N/A | |
| MSDS | USA | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid |
|---|---|
| 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.
| Molecular Formula | C9H11NO2 |
|---|---|
| Molecular Weight | 165.18900 |
| Exact Mass | 165.07900 |
| PSA | 53.09000 |
| LogP | 1.59170 |
| InChIKey | NYZDHGPFNPXPCM-UHFFFAOYSA-N |
| SMILES | O=C(O)c1cc2c([nH]1)CCCC2 |
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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~78%
4,5,6,7-Tetrahy... CAS#:131172-64-0 |
| Literature: Varnavas, Antonio; Lassiani, Lucia; Valenta, Valentina; Berti, Federico; Tontini, Andrea; Mennuni, Laura; Makovec, Francesco European Journal of Medicinal Chemistry, 2004 , vol. 39, # 1 p. 85 - 97 |
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~45%
4,5,6,7-Tetrahy... CAS#:131172-64-0 |
| Literature: Clarisse, Damien; Fenet, Bernard; Fache, Fabienne Organic and Biomolecular Chemistry, 2012 , vol. 10, # 32 p. 6587 - 6594 |
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~86%
4,5,6,7-Tetrahy... CAS#:131172-64-0 |
| Literature: Sobenina, L. N.; Sergeeva, M. P.; Mikhaleva, A. I.; Sigalov, M. V.; Korostova, S. E.; et al. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1990 , vol. 26, # 5 p. 516 - 520 Khimiya Geterotsiklicheskikh Soedinenii, 1990 , # 5 p. 612 - 616 |
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~%
4,5,6,7-Tetrahy... CAS#:131172-64-0 |
| Literature: Chemistry of Heterocyclic Compounds (New York, NY, United States), , vol. 26, # 5 p. 516 - 520 Khimiya Geterotsiklicheskikh Soedinenii, , # 5 p. 612 - 616 |
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~%
4,5,6,7-Tetrahy... CAS#:131172-64-0 |
| Literature: Justus Liebigs Annalen der Chemie, , vol. 524, p. 285,289 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| 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: Inhibition of human recombinant N-terminal His-tagged DDO expressed in Escherichia co...
Source: ChEMBL
Target: D-aspartate oxidase
External Id: CHEMBL2327933
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Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262
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Name: Inhibition of human recombinant N-terminal His-tagged DAO expressed in Escherichia co...
Source: ChEMBL
Target: D-amino-acid oxidase
External Id: CHEMBL2327932
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Name: Chemical Probes of Kaposi's Sarcoma Herpes Virus Latent Infection
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: ORF 73 [Human herpesvirus 8 type M]
External Id: HMS791
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Name: Inhibition of human recombinant N-terminal His-tagged serine racemase expressed in Es...
Source: ChEMBL
Target: Serine racemase
External Id: CHEMBL2327930
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Name: High-throughput screen for inhibitors of the GIV GBA-motif interaction with Galpha-i ...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS1303
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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: A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: Chain A, Poliovirus Polymerase With Gtp
External Id: HMS750
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1H-Indole-2-carboxylicacid,4,5,6,7-tetrahydro |
| 4,5,6,7-tetrahydro-indole-2-carboxylic acid |
| 4,5,6,7-Tetrahydro-indol-2-carbonsaeure |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid? |
| A: Molecular weight of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid is 165.18900. |
| Q: What are the upstream materials of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid? |
| A: Related upstream materials(CAS) of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid: 65880-18-4;1477-50-5;131172-58-2;65541-69-7;822-87-7. |
| Q: What is the English name of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid? |
| A: The English name of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid is 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid. |
| Q: What is the CAS number of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid? |
| A: CAS number of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid is 131172-64-0. |
| Q: What is the SMILES notation of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid? |
| A: SMILES notation of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid is O=C(O)c1cc2c([nH]1)CCCC2. |
| Q: What is the InChIKey of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid? |
| A: InChIKey of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid is NYZDHGPFNPXPCM-UHFFFAOYSA-N. |
| Q: What is the LogP of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid? |
| A: LogP of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid is 1.59170. |
| Q: What English synonyms does 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid have? |
| A: English synonyms of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid: 1H-Indole-2-carboxylicacid,4,5,6,7-tetrahydro, 4,5,6,7-tetrahydro-indole-2-carboxylic acid, 4,5,6,7-Tetrahydro-indol-2-carbonsaeure. |
| Q: What is the molecular formula of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid? |
| A: Molecular formula of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid is C9H11NO2. |
| Q: What is the polar surface area (PSA) of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid? |
| A: Polar surface area (PSA) of 4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid is 53.09000. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |