Methyl 6-methoxy-2-methylpyridine-3-carboxylate
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Basic information
- CAS
137347-39-8- Standard SMILES
COC(=O)c1ccc(OC)nc1C- InChIKey
LOCSATDVCLSGPT-UHFFFAOYSA-N- Molecular formula
- C9H11NO3
- Average molar mass
- 181.19 g/mol
- Monoisotopic mass
- 181.07389321
Names & identifiers
- Preferred name
- Methyl 6-methoxy-2-methylpyridine-3-carboxylate
- IUPAC
- methyl 6-methoxy-2-methylpyridine-3-carboxylate
- English name
- Methyl 6-methoxy-2-methylnicotinate
- Molecular formula
- C9H11NO3
- Molecular weight
- 181.19
Names & synonyms
137347-39-8Methyl 6-methoxy-2-methylpyridine-3-carboxylateRefChem:817423888-061-7Methyl 6-methoxy-2-methylnicotinateMFCD166116403-Pyridinecarboxylic acid, 6-methoxy-2-methyl-, methyl esterSCHEMBL21041119Methyl6-methoxy-2-methylnicotinateMethyl-6-methoxy-2-methylnicotinateAKOS027429248SB52918
Show more names
AS-71051SY126321CS-00357966-Methoxy-2-methyl-nicotinic acid methyl esterW12734EN300-7400056F530946methyl 6-methoxy-2-methyl-pyridine-3-carboxylate
Database identifiers
- CAS
137347-39-8- PubChem CID
- 85617652
- EC Number
- 888-061-7
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- Boiling point
- 243.4 · 243.4±35.0 °C(Predicted)
- Density
- 1.126 · 1.126±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- 2.08 · 2.08±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-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
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%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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