(S)-tert-butyl 1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propylcarbamate
Basic information
- Standard SMILES
CC[C@H](NC(=O)OC(C)(C)C)c1ccc(B2OC(C)(C)C(C)(C)O2)cc1- InChIKey
IEMJYRJLRBWDFB-INIZCTEOSA-N- Molecular formula
- C20H32BNO4
- Average molar mass
- 361.3 g/mol
- Monoisotopic mass
- 361.2424387
Names & identifiers
- Preferred name
- (S)-tert-butyl 1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propylcarbamate
- IUPAC
- tert-butyl N-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propyl]carbamate
Names & synonyms
SCHEMBL15092929IEMJYRJLRBWDFB-INIZCTEOSA-N(S)-tert-butyl 1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propylcarbamate
Database identifiers
- PubChem CID
- 86689445
Properties
Computed structural properties
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 477
Related reactions
1 records
Compound notes
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