Basic information
- CAS
79128-69-1- Standard SMILES
COC(=O)c1sccc1NC(=O)C(C)(C)C- InChIKey
UMECWUPJPGGLTL-UHFFFAOYSA-N- Molecular formula
- C11H15NO3S
- Average molar mass
- 241.31 g/mol
- Monoisotopic mass
- 241.07726451
Names & identifiers
- Preferred name
- Methyl 3-(2,2-dimethylpropanoylamino)thiophene-2-carboxylate
- IUPAC
- methyl 3-(2,2-dimethylpropanoylamino)thiophene-2-carboxylate
Names & synonyms
79128-69-1methyl 3-(2,2-dimethylpropanamido)thiophene-2-carboxylatemethyl 3-(2,2-dimethylpropanoylamino)thiophene-2-carboxylateMFCD00665576methyl 3-[(2,2-dimethylpropanoyl)amino]-2-thiophenecarboxylateMethyl 3-pivalamidothiophene-2-carboxylateOprea1_099934DTXSID701167628HMS1662P16STK375996AKOS0032651015H-370S
Show more names
CS-0361830ST50917089methyl3-(2,2-dimethylpropanamido)thiophene-2-carboxylatemethyl 3-[(2,2-dimethylpropanoyl)amino]thiophene-2-carboxylateMethyl 3-[(2,2-dimethyl-1-oxopropyl)amino]-2-thiophenecarboxylate
Database identifiers
- CAS
79128-69-1- PubChem CID
- 2809683
- DTXSID
DTXSID701167628
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 83.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 285
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…