Basic information
- CAS
937605-63-5- Standard SMILES
Cc1nn(CC(=O)O)c2ncccc12- InChIKey
IOVXRMSVGNLWGP-UHFFFAOYSA-N- Molecular formula
- C9H9N3O2
- Average molar mass
- 191.19 g/mol
Names & identifiers
- Preferred name
- (3-Methyl-1H-pyrazolo[3,4-B]pyridin-1-YL)acetic acid
- IUPAC
- 2-(3-methylpyrazolo[5,4-b]pyridin-1-yl)acetic acid
- English name
- (3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
- Molecular formula
- C9H9N3O2
- Molecular weight
- 191.19
Names & synonyms
937605-63-52-(3-Methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid(3-METHYL-1H-PYRAZOLO[3,4-B]PYRIDIN-1-YL)ACETIC ACID2-{3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl}acetic acidMFCD086967122-(3-methylpyrazolo[3,4-b]pyridin-1-yl)acetic acid2-(3-methylpyrazolo[5,4-b]pyridinyl)acetic acidMMB60563SBB036431STL411799AKOS000314298ST099378
Show more names
1H-Pyrazolo[3,4-b]pyridine-1-acetic acid, 3-methyl-
EN300-92360G550902-(3-Methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)aceticacidZ1198181440
Database identifiers
- CAS
937605-63-5
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 68 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 234
Physicochemical properties
- Boiling point
- 411.3 · 411.3±35.0 °C(Predicted)
- Density
- 1.42 · 1.42±0.1 g/cm3(Predicted)
- storage temp.
- Store at Room Tem.
- pka
- 3.04 · 3.04±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Chemistry & industry
Suppliers1 total
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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