1H,4H,5H,6H,7H-pyrazolo(3,4-b)pyridine-4-carboxylic acid hydrochloride
Basic information
- CAS
2580199-53-5- Standard SMILES
Cl.O=C(O)C1CCNc2[nH]ncc21- InChIKey
OHRQZJYYAWRAJK-UHFFFAOYSA-N- Molecular formula
- C7H10ClN3O2
- Average molar mass
- 203.62 g/mol
- Monoisotopic mass
- 203.0461543
Names & identifiers
- Preferred name
- 1H,4H,5H,6H,7H-pyrazolo(3,4-b)pyridine-4-carboxylic acid hydrochloride
- IUPAC
- 4,5,6,7-tetrahydro-1H-pyrazolo[5,4-b]pyridine-4-carboxylic acid;hydrochloride
Names & synonyms
2580199-53-51H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridine-4-carboxylic acid hydrochloride1H,4H,5H,6H,7H-pyrazolo(3,4-b)pyridine-4-carboxylic acid hydrochlorideRefChem:437765896-269-44,5,6,7-Tetrahydro-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid;hydrochloride1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridine-4-carboxylicacidhydrochlorideEN300-27701159Z4870337694
Database identifiers
- CAS
2580199-53-5- PubChem CID
- 155858905
- EC Number
- 896-269-4
Properties
Computed structural properties
- Topological polar surface area
- 78 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 197
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
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Compound notes
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