Basic information
- CAS
341030-45-3- Standard SMILES
Cc1cc(CNC(=O)OC(C)(C)C)no1- InChIKey
NGUMJPMPYNAHKE-UHFFFAOYSA-N- Molecular formula
- C10H16N2O3
- Average molar mass
- 212.25 g/mol
Names & identifiers
- Preferred name
- tert-Butyl ((5-methylisoxazol-3-yl)methyl)carbamate
- IUPAC
- tert-butyl N-[(5-methyl-1,2-oxazol-3-yl)methyl]carbamate
- English name
- Carbamic acid, [(5-methyl-3-isoxazolyl)methyl]-, 1,1-dimethylethyl ester (9CI)
- Molecular formula
- C10H16N2O3
- Molecular weight
- 212.25
Names & synonyms
tert-Butyl ((5-methylisoxazol-3-yl)methyl)carbamate341030-45-3tert-butyl N-[(5-methyl-1,2-oxazol-3-yl)methyl]carbamateSCHEMBL19489299AKOS013101189Carbamic acid, [(5-methyl-3-isoxazolyl)methyl]-, 1,1-dimethylethyl ester (9CI)
Database identifiers
- CAS
341030-45-3
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 225
Physicochemical properties
- Boiling point
- 349 · 349.0±30.0 °C(Predicted)
- Density
- 1.1 · 1.100±0.06 g/cm3(Predicted)
- pka
- 11.16 · 11.16±0.46(Predicted)
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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