Cas no 1337880-39-3 (3-hydroxyisoquinoline-6-carboxylic acid)
3-Hydroxyisoquinoline-6-carboxylic acid is a heterocyclic carboxylic acid derivative with a molecular structure that combines a hydroxy-substituted isoquinoline core with a carboxyl functional group at the 6-position. This compound is of interest in pharmaceutical and chemical research due to its potential as a versatile intermediate in the synthesis of bioactive molecules, particularly in the development of enzyme inhibitors and metal-chelating agents. Its dual functionality (hydroxy and carboxyl groups) enables selective modifications, facilitating its use in medicinal chemistry and coordination chemistry applications. The compound's stability and reactivity make it suitable for further derivatization, offering researchers a valuable building block for targeted molecular design.
1337880-39-3 structure
Product Name:3-hydroxyisoquinoline-6-carboxylic acid
CAS No:1337880-39-3
MF:C10H7NO3
MW:189.167482614517
MDL:MFCD22380184
CID:1233980
PubChem ID:129978840
Update Time:2025-11-06
3-hydroxyisoquinoline-6-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 3-hydroxy-6-isoquinolinecarboxylic Acid
- 3-hydroxyisoquinoline-6-carboxylic acid
- AT32111
- 3-Oxo-2H-isoquinoline-6-carboxylic acid
- 1337880-39-3
- 3-hydroxyisoquinoline-6-carboxylicacid
- EN300-322117
-
- MDL： MFCD22380184
- Inchi： 1S/C10H7NO3/c12-9-4-8-3-6(10(13)14)1-2-7(8)5-11-9/h1-5H,(H,11,12)(H,13,14)
- InChI Key： HGSGOKOTKXEKRI-UHFFFAOYSA-N
- SMILES： O=C1C=C2C=C(C(=O)O)C=CC2=CN1
Computed Properties
- Exact Mass: 189.042593085g/mol
- Monoisotopic Mass: 189.042593085g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 438
- 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
- XLogP3: -0.2
- Topological Polar Surface Area: 66.4?2
3-hydroxyisoquinoline-6-carboxylic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-322117-0.05g |
3-hydroxyisoquinoline-6-carboxylic acid |
1337880-39-3 | 0.05g |
$515.0 | 2023-09-04 | ||
| Enamine | EN300-322117-0.1g |
3-hydroxyisoquinoline-6-carboxylic acid |
1337880-39-3 | 0.1g |
$540.0 | 2023-09-04 | ||
| Enamine | EN300-322117-0.25g |
3-hydroxyisoquinoline-6-carboxylic acid |
1337880-39-3 | 0.25g |
$564.0 | 2023-09-04 | ||
| Enamine | EN300-322117-0.5g |
3-hydroxyisoquinoline-6-carboxylic acid |
1337880-39-3 | 0.5g |
$589.0 | 2023-09-04 | ||
| Enamine | EN300-322117-1.0g |
3-hydroxyisoquinoline-6-carboxylic acid |
1337880-39-3 | 1g |
$0.0 | 2023-06-05 | ||
| Enamine | EN300-322117-2.5g |
3-hydroxyisoquinoline-6-carboxylic acid |
1337880-39-3 | 2.5g |
$1202.0 | 2023-09-04 | ||
| Enamine | EN300-322117-5.0g |
3-hydroxyisoquinoline-6-carboxylic acid |
1337880-39-3 | 5.0g |
$4349.0 | 2023-02-24 | ||
| Enamine | EN300-322117-10.0g |
3-hydroxyisoquinoline-6-carboxylic acid |
1337880-39-3 | 10.0g |
$6450.0 | 2023-02-24 | ||
| Enamine | EN300-322117-1g |
3-hydroxyisoquinoline-6-carboxylic acid |
1337880-39-3 | 1g |
$614.0 | 2023-09-04 | ||
| Enamine | EN300-322117-5g |
3-hydroxyisoquinoline-6-carboxylic acid |
1337880-39-3 | 5g |
$1779.0 | 2023-09-04 |
3-hydroxyisoquinoline-6-carboxylic acid Related Literature
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
-
Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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