5-Chloro-1H-pyrrolo(2,3-c)pyridine-3-carboxylic acid
Basic information
- CAS
1067193-36-5- Standard SMILES
O=C(O)c1c[nH]c2cnc(Cl)cc12- InChIKey
AVPUJBXNXVWMSX-UHFFFAOYSA-N- Molecular formula
- C8H5ClN2O2
- Average molar mass
- 196.59 g/mol
- Monoisotopic mass
- 196.0039551
Names & identifiers
- Preferred name
- 5-Chloro-1H-pyrrolo(2,3-c)pyridine-3-carboxylic acid
- IUPAC
- 5-chloro-1H-pyrrolo[2,3-c]pyridine-3-carboxylic acid
- English name
- 5-Chloro-6-azaindole-3-carboxylic acid
- Molecular formula
- C8H5ClN2O2
- Molecular weight
- 196.59
Names & synonyms
1067193-36-55-Chloro-1H-pyrrolo[2,3-c]pyridine-3-carboxylic acidDTXSID906945585-Chloro-1H-pyrrolo(2,3-c)pyridine-3-carboxylic acidRefChem:302258DTXCID30645307894-712-65-Chloro-6-azaindole-3-carboxylic acidMFCD12405148SCHEMBL2817633AKOS022172941DS-7178
Show more names
1H-Pyrrolo[2,3-c]pyridine-3-carboxylic acid, 5-chloro-
PB39516SY029979EN300-7395091AMY7402A895751SCHEMBL31153473SSB193365-Chloro-1H-pyrrolo[2,3-c]pyridine-3-c
Database identifiers
- CAS
1067193-36-5- PubChem CID
- 53399152
- DTXSID
DTXSID90694558- EC Number
- 894-712-6
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 224
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Appearance
- Off-white to light yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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