tert-butyl N-[(2R)-2-hydroxypentyl]carbamate
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Basic information
- CAS
214679-14-8- Standard SMILES
CCC[C@@H](O)CNC(=O)OC(C)(C)C- InChIKey
LTROXMBWKFJLGH-MRVPVSSYSA-N- Molecular formula
- C10H21NO3
- Average molar mass
- 203.28 g/mol
Names & identifiers
- Preferred name
- tert-butyl N-[(2R)-2-hydroxypentyl]carbamate
- IUPAC
- tert-butyl N-[(2R)-2-hydroxypentyl]carbamate
- English name
- Carbamic acid, [(2R)-2-hydroxypentyl]-, 1,1-dimethylethyl ester (9CI)
- Molecular formula
- C10H21NO3
- Molecular weight
- 203.28
Names & synonyms
Carbamic acid, [(2R)-2-hydroxypentyl]-, 1,1-dimethylethyl ester (9CI)
Database identifiers
- CAS
214679-14-8
Properties
Computed structural propertiesFilling in
- XLogP
- 1.6
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 175
Physicochemical properties
- Boiling point
- 309.1 · 309.1±25.0 °C(Predicted)
- Density
- 0.997 · 0.997±0.06 g/cm3(Predicted)
- pka
- 12.39 · 12.39±0.46(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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