Basic information
- CAS
20278-31-3- Standard SMILES
CC(C)(C)NC=S- InChIKey
SKMRMWZJEZBLML-UHFFFAOYSA-N- Molecular formula
- C5H11NS
- Average molar mass
- 117.22 g/mol
- Monoisotopic mass
- 117.06122053
Names & identifiers
- Preferred name
- N-tert-Butylmethanethioamide
- IUPAC
- N-tert-butylmethanethioamide
Names & synonyms
20278-31-3N-tert-ButylmethanethioamideSCHEMBL270998SCHEMBL270999SCHEMBL15223127SCHEMBL19474223SCHEMBL22866861DTXSID20494886AKOS006349324
Database identifiers
- CAS
20278-31-3- PubChem CID
- 12371896
- DTXSID
DTXSID20494886- Nikkaji
- J2.740.281J
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 63
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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