Basic information
- Standard SMILES
CC(C)[Si](OC1=C[C@@H](N)[C@H](c2cc(F)c(F)cc2F)CC1)(C(C)C)C(C)C- InChIKey
JHDRJYFJCHCWPH-HRAATJIYSA-N- Molecular formula
- C21H32F3NOSi
- Average molar mass
- 399.6 g/mol
- Monoisotopic mass
- 399.22052566
Names & identifiers
- Preferred name
- trans 6-(2,4,5-Trifluorophenyl)-3-[(triisopropylsilyl)oxy]cyclohex-2-en-1-amine
- IUPAC
- (1S,6S)-6-(2,4,5-trifluorophenyl)-3-tri(propan-2-yl)silyloxycyclohex-2-en-1-amine
Names & synonyms
SCHEMBL1528440JHDRJYFJCHCWPH-HRAATJIYSA-Ntrans 6-(2,4,5-Trifluorophenyl)-3-[(triisopropylsilyl)oxy]cyclohex-2-en-1-aminetrans-6-(2,4,5-trifluorophenyl)-3-[(triisopropylsilyl)oxy]cyclohex-2-en-1-amine
Database identifiers
- PubChem CID
- 67065833
Properties
Computed structural properties
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 504
Related reactions
4 records
Compound notes
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