methyl 3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylate
Basic information
- CAS
1423031-49-5- Standard SMILES
COC(=O)c1ccc2n[nH]c(=O)n2c1- InChIKey
DKKCKENBWVQKEO-UHFFFAOYSA-N- Molecular formula
- C8H7N3O3
- Average molar mass
- 193.16 g/mol
- Monoisotopic mass
- 193.04874109
Names & identifiers
- Preferred name
- methyl 3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylate
- IUPAC
- methyl 3-oxo-2H-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylate
Names & synonyms
methyl 3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylate1423031-49-5methyl 3-oxo-2H,3H-(1,2,4)triazolo(4,3-a)pyridine-6-carboxylateRefChem:815613874-183-8METHYL 3-OXO-2H-[1,2,4]TRIAZOLO[4,3-A]PYRIDINE-6-CARBOXYLATEMethyl 3-oxo-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylateYGC03149AKOS020142680CS-0223077EN300-113812Z1464114894
Database identifiers
- CAS
1423031-49-5- PubChem CID
- 71756771
- EC Number
- 874-183-8
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 71 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 395
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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