Basic information
- CAS
164721-32-8- Standard SMILES
COC(=O)c1nc(OC)ccc1O- InChIKey
CXIYKAIOXVEZAP-UHFFFAOYSA-N- Molecular formula
- C8H9NO4
- Average molar mass
- 183.16 g/mol
Names & identifiers
- Preferred name
- Methyl 3-hydroxy-6-methoxypicolinate
- IUPAC
- methyl 3-hydroxy-6-methoxypyridine-2-carboxylate
Names & synonyms
164721-32-8Methyl 3-hydroxy-6-methoxypicolinatemethyl 3-hydroxy-6-methoxypyridine-2-carboxylatemethyl3-hydroxy-6-methoxypyridine-2-carboxylateSCHEMBL5583709CXIYKAIOXVEZAP-UHFFFAOYSA-NMethyl 3-hydroxy-6-methoxy-picolinateEN300-24209108
Database identifiers
- CAS
164721-32-8- PubChem CID
- 17817640
- EC Number
- 119-218-3
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 68.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 185
Safety & regulation
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%)
Related reactions
4 records
Compound notes
Loading…