Basic information
- Standard SMILES
C[C@@H](CNC(=O)OC(C)(C)C)c1ccc(O)c(O)c1- InChIKey
CLVPBMKJBAKPKO-VIFPVBQESA-N- Molecular formula
- C14H21NO4
- Average molar mass
- 267.32 g/mol
Names & identifiers
- Preferred name
- (R)-2-(3,4-Dihydroxyphenyl)propylcarbamic acid, t-butyl ester
- IUPAC
- tert-butyl N-[(2R)-2-(3,4-dihydroxyphenyl)propyl]carbamate
Names & synonyms
CLVPBMKJBAKPKO-VIFPVBQESA-N(R)-2-(3,4-Dihydroxyphenyl)propylcarbamic acid, t-butyl ester
Database identifiers
- PubChem CID
- 86752190
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 300
Related reactions
1 records
Compound notes
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