4-Bromo-3-methoxy-2-methylpyridine
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Basic information
- CAS
1227592-47-3- Standard SMILES
COc1c(Br)ccnc1C- InChIKey
FMULTJAREUPAMK-UHFFFAOYSA-N- Molecular formula
- C7H8BrNO
- Average molar mass
- 202.05 g/mol
- Monoisotopic mass
- 200.97893
Names & identifiers
- Preferred name
- 4-Bromo-3-methoxy-2-methylpyridine
- IUPAC
- 4-bromo-3-methoxy-2-methylpyridine
- English name
- 4-BROMO-3-METHOXY-2-METHYLPYRIDINE
- Molecular formula
- C7H8BrNO
- Molecular weight
- 202.05
Names & synonyms
4-BROMO-3-METHOXY-2-METHYLPYRIDINE1227592-47-3Pyridine, 4-bromo-3-methoxy-2-methyl-MFCD16610114SCHEMBL281903314-bromo-3-methoxy-2-methyl-pyridineAKOS027296720AS-44375DB-367516CS-0059852A11666EN300-213822
Show more names
F542362
Database identifiers
- CAS
1227592-47-3- PubChem CID
- 118797340
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 110
Physicochemical properties
- Boiling point
- 232.3 · 232.3±35.0 °C(Predicted)
- Density
- 1.452 · 1.452±0.06 g/cm3(Predicted)
- pka
- 5.45 · 5.45±0.10(Predicted)
- 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.
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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