Carbamic acid, methyl[(1-methyl-1H-imidazol-5-yl)methyl]-, 1,1-dimethylethyl ester
Basic information
- CAS
384821-20-9- Standard SMILES
CN(Cc1cncn1C)C(=O)OC(C)(C)C- InChIKey
IFLAKVGUWHVXIV-UHFFFAOYSA-N- Molecular formula
- C11H19N3O2
- Average molar mass
- 225.29 g/mol
- Monoisotopic mass
- 225.14772686
Names & identifiers
- Preferred name
- Carbamic acid, methyl[(1-methyl-1H-imidazol-5-yl)methyl]-, 1,1-dimethylethyl ester
- IUPAC
- tert-butyl N-methyl-N-[(3-methylimidazol-4-yl)methyl]carbamate
Names & synonyms
DTXSID401131254Carbamic acid, methyl[(1-methyl-1H-imidazol-5-yl)methyl]-, 1,1-dimethylethyl ester384821-20-9tert-Butyl methyl[(1-methyl-1H-imidazol-5-yl)methyl]carbamate
Database identifiers
- CAS
384821-20-9- PubChem CID
- 11042404
- DTXSID
DTXSID401131254
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 47.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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