Basic information
- CAS
356562-19-1- Standard SMILES
CC(C)(C)NC(=O)c1ccc(Br)o1- InChIKey
WXIZGHGFAMCKTD-UHFFFAOYSA-N- Molecular formula
- C9H12BrNO2
- Average molar mass
- 246.1 g/mol
- Monoisotopic mass
- 245.00514
Names & identifiers
- Preferred name
- 5-bromo-N-tert-butylfuran-2-carboxamide
- IUPAC
- 5-bromo-N-tert-butylfuran-2-carboxamide
- English name
- 5-bromo-N-(tert-butyl)-2-furamide
- Molecular formula
- C9H12BrNO2
- Molecular weight
- 246.1
Names & synonyms
356562-19-15-bromo-N-tert-butylfuran-2-carboxamideDTXSID40356735RefChem:302031DTXCID103077945-BROMO-N-(TERT-BUTYL)-2-FURAMIDE5-Bromo-N-(tert-butyl)furan-2-carboxamideMFCD00625618Oprea1_151027SCHEMBL16142979STL071105AKOS000500121
Show more names
5-bromo-N-(tert-butyl)-2-furamide(SALTDATA: FREE)2-Furancarboxamide, 5-bromo-N-(1,1-dimethylethyl)-
5-bromo-N-tert-butyl-furan-2-carboxamideBS-36702DB-263514CS-0327574ST45049709N-(tert-butyl)(5-bromo(2-furyl))carboxamideAG-205/05945054F315124
Database identifiers
- CAS
356562-19-1- PubChem CID
- 830695
- DTXSID
DTXSID40356735
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 42.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 200
Physicochemical properties
- Boiling point
- 310 · 310.0±27.0 °C(Predicted)
- Density
- 1.38 · 1.380±0.06 g/cm3(Predicted)
- pka
- 14.22 · 14.22±0.46(Predicted)
Chemistry & industry
Suppliers2 total
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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