5-(Tert-butyl)-2-methyl-3-furamide
Basic information
- CAS
175276-67-2- Standard SMILES
Cc1oc(C(C)(C)C)cc1C(N)=O- InChIKey
JERNMWLTDZPEAE-UHFFFAOYSA-N- Molecular formula
- C10H15NO2
- Average molar mass
- 181.23 g/mol
- Monoisotopic mass
- 181.11027872
Names & identifiers
- Preferred name
- 5-(Tert-butyl)-2-methyl-3-furamide
- IUPAC
- 5-tert-butyl-2-methylfuran-3-carboxamide
- English name
- 5-(tert-Butyl)-2-methyl-3-furamide
- Molecular formula
- C10H15NO2
- Molecular weight
- 181.23
Names & synonyms
175276-67-25-(tert-butyl)-2-methylfuran-3-carboxamide5-(tert-butyl)-2-methyl-3-furamide5-tert-butyl-2-methylfuran-3-carboxamideMFCD00276989Maybridge3_007000Oprea1_137885MLS000862058CHEMBL1608844SCHEMBL13076637DTXSID80351587HMS1450O04
Show more names
3-Furancarboxamide, 5-(1,1-dimethylethyl)-2-methyl-
HMS2802A04STK677069AKOS005594488IDI1_018387SMR0004611405-tert-butyl-2-methyl-furan-3-carboxamideST4060973CS-0328511
Database identifiers
- CAS
175276-67-2- PubChem CID
- 704149
- DTXSID
DTXSID80351587- ChEMBL
CHEMBL1608844
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 56.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 207
Experimental & physicochemical properties
Solubility>27.2 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Boiling point
- 248.4 · 248.4±40.0 °C(Predicted)
- Density
- 1.042 · 1.042±0.06 g/cm3(Predicted)
- pka
- 15.77 · 15.77±0.50(Predicted)
- HS Code
- 2932190090 · 2932190090
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
- hs_code
- 2932190090
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…