6-Methyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid
Basic information
- CAS
1000340-27-1- Standard SMILES
Cc1ccc2c(C(=O)O)c[nH]c2n1- InChIKey
QDLZITJKHXRFDU-UHFFFAOYSA-N- Molecular formula
- C9H8N2O2
- Average molar mass
- 176.17 g/mol
- Monoisotopic mass
- 176.0585775
Names & identifiers
- Preferred name
- 6-Methyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid
- IUPAC
- 6-methyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid
- English name
- 1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 6-methyl-
- Molecular formula
- C9H8N2O2
- Molecular weight
- 176.17
Names & synonyms
1000340-27-16-Methyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid6-Methyl-7-azaindole-3-carboxylic acidMFCD098801151H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 6-methyl-6-Methyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylicacidSCHEMBL23749744SCHEMBL30392836DTXSID30646874AKOS006312990SB14336SY386610
Show more names
2-(6-METHYL-1H-PYRROLO[2,3-B]PYRIDIN-3-YL)ACETIC ACID
CS-0054381P108281H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 6-methyl-
Database identifiers
- CAS
1000340-27-1- PubChem CID
- 24729554
- DTXSID
DTXSID30646874
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 220
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Appearance
- yellow to pale brown powder
- 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
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…