- Discovery and optimization of indoles and 7-azaindoles as Rho kinase (ROCK) inhibitors (part-I)Chowdhury, Sarwat; et al, Bioorganic & Medicinal Chemistry Letters, 2011, 21(23), 7107-7112
Cas no 915140-96-4 (6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid)
915140-96-4 structure
Product Name:6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid
CAS No:915140-96-4
MF:C8H5ClN2O2
MW:196.590500593185
MDL:MFCD11518910
CID:796855
PubChem ID:45121070
Update Time:2024-10-26
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid
- 1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 6-chloro-
- 6-Chloro-7-azaindole-3-carboxylic acid
- 6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid (ACI)
- MFCD11518910
- SCHEMBL3554174
- AKOS006325784
- PB16396
- AS-36114
- DTXSID80669119
- CS-0002354
- J-518500
- 1H-6-Chloro-pyrrolo[2,3-b]pyridine-3-carboxylic acid
- 6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylicacid
- 915140-96-4
- EN300-6479707
-
- MDL: MFCD11518910
- Inchi: 1S/C8H5ClN2O2/c9-6-2-1-4-5(8(12)13)3-10-7(4)11-6/h1-3H,(H,10,11)(H,12,13)
- InChI Key: NPXFUIWZQKUEQK-UHFFFAOYSA-N
- SMILES: O=C(C1C2C(=NC(=CC=2)Cl)NC=1)O
Computed Properties
- Exact Mass: 210.02000
- Monoisotopic Mass: 196.004
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 224
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 66A^2
- XLogP3: 1.8
Experimental Properties
- Color/Form: OFF-WHITE SOLID
- Density: 1.566
- Refractive Index: 1.711
- PSA: 65.98000
- LogP: 1.84340
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid Security Information
- Signal Word:Warning
- Hazard Statement: H302;H315;H319;H335
- Warning Statement: P261;P280;P301+P312;P302+P352;P305+P351+P338
- Storage Condition:2-8 °C
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid Customs Data
- HS CODE:2933990090
- Customs Data:
China Customs Code:
2933990090Overview:
2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date
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%
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| AstaTech | 52597-0.25/G |
6-CHLORO-1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLIC ACID |
915140-96-4 | 95% | 0.25g |
$336 | 2023-09-17 | |
| AstaTech | 52597-1/G |
6-CHLORO-1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLIC ACID |
915140-96-4 | 95% | 1g |
$672 | 2023-09-17 | |
| AstaTech | 52597-5/G |
6-CHLORO-1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLIC ACID |
915140-96-4 | 95% | 5/G |
$1994 | 2022-06-02 | |
| Fluorochem | 227827-250mg |
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid |
915140-96-4 | 95% | 250mg |
£378.00 | 2022-02-28 | |
| Fluorochem | 227827-1g |
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid |
915140-96-4 | 95% | 1g |
£756.00 | 2022-02-28 | |
| Fluorochem | 227827-5g |
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid |
915140-96-4 | 95% | 5g |
£2244.00 | 2022-02-28 | |
| Alichem | A029183245-250mg |
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid |
915140-96-4 | 95% | 250mg |
$236.00 | 2023-08-31 | |
| Alichem | A029183245-1g |
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid |
915140-96-4 | 95% | 1g |
$589.00 | 2023-08-31 | |
| Chemenu | CM148249-100mg |
6-Chloro-7-azaindole-3-carboxylic acid |
915140-96-4 | 95%+ | 100mg |
$275 | 2021-08-05 | |
| Chemenu | CM148249-250mg |
6-Chloro-7-azaindole-3-carboxylic acid |
915140-96-4 | 95%+ | 250mg |
$385 | 2021-08-05 |
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid Production Method
Production Method 1
Reaction Conditions
1.1 1 h, 0 °C; 14 h, rt
1.2 Reagents: Sodium hydroxide Solvents: Water ; 10 h, 80 °C
1.2 Reagents: Sodium hydroxide Solvents: Water ; 10 h, 80 °C
Reference
Production Method 2
Reaction Conditions
1.1 Reagents: m-Chloroperbenzoic acid Solvents: Diethyl ether ; 5 min, 0 °C; 2 h, rt
1.2 Reagents: Ethyl chloroformate , Hexamethyldisilazane Solvents: Tetrahydrofuran ; 4 h, rt
1.3 Reagents: Sodium hydroxide Solvents: Methanol , Water ; 6 h, rt
2.1 1 h, 0 °C; 14 h, rt
2.2 Reagents: Sodium hydroxide Solvents: Water ; 10 h, 80 °C
1.2 Reagents: Ethyl chloroformate , Hexamethyldisilazane Solvents: Tetrahydrofuran ; 4 h, rt
1.3 Reagents: Sodium hydroxide Solvents: Methanol , Water ; 6 h, rt
2.1 1 h, 0 °C; 14 h, rt
2.2 Reagents: Sodium hydroxide Solvents: Water ; 10 h, 80 °C
Reference
- Discovery and optimization of indoles and 7-azaindoles as Rho kinase (ROCK) inhibitors (part-I)Chowdhury, Sarwat; et al, Bioorganic & Medicinal Chemistry Letters, 2011, 21(23), 7107-7112
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid Raw materials
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid Preparation Products
6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid Related Literature
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
-
Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
915140-96-4 (6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid) Related Products
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- 1203498-99-0(5-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid)
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