N-(5-Bromo-2-methoxypyridin-3-yl)methanesulfonamide
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Basic information
- CAS
1083327-58-5- Standard SMILES
COc1ncc(Br)cc1NS(C)(=O)=O- InChIKey
IHOAJGDCQMBZDI-UHFFFAOYSA-N- Molecular formula
- C7H9BrN2O3S
- Average molar mass
- 281.13 g/mol
- Monoisotopic mass
- 279.95173
Names & identifiers
- Preferred name
- N-(5-Bromo-2-methoxypyridin-3-yl)methanesulfonamide
- IUPAC
- N-(5-bromo-2-methoxy-3-pyridinyl)methanesulfonamide
- English name
- N-(5-broMo-2-Methoxypyridin-3-yl)MethanesulfonaMide
- Molecular formula
- C7H9BrN2O3S
- Molecular weight
- 281.13
Names & synonyms
N-(5-bromo-2-methoxypyridin-3-yl)methanesulfonamide1083327-58-5DTXSID00733245RefChem:362324DTXCID10683989N-[5-bromo-2-(methyloxy)-3-pyridinyl]methanesulfonamideSCHEMBL114826SCHEMBL29556703IHOAJGDCQMBZDI-UHFFFAOYSA-NMFCD22989195AKOS016845193DB-371279
Show more names
Methanesulfonamide, N-(5-bromo-2-methoxy-3-pyridinyl)-N-?[5-?bromo-?2-?(methyloxy)?-?3-?pyridinyl]?methanesulfonamide
CS-0329694N-(5-bromo-2-methoxy-3-pyridyl)methanesulfonamideN-(5-Bromo-2-methoxypyridin-3-yl)methanesulphonamideN-(5-Bromo-2-methoxypyridin-3-yl)methanesulfonamide, 97%
Database identifiers
- CAS
1083327-58-5- PubChem CID
- 59860141
- DTXSID
DTXSID00733245
Properties
Computed structural propertiesFilling in
- XLogP
- 0.8
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 277
Physicochemical properties
- Boiling point
- 357.8 · 357.8±52.0 °C(Predicted)
- Density
- 1.721 · 1.721±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 5.83 · 5.83±0.50(Predicted)
Related reactions
13 records
Compound notes
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