rel-(1R,4r)-4-((tert-butyldiphenylsilyl)oxy)cyclohexan-1-amine
Basic information
- CAS
1335139-46-2- Standard SMILES
CC(C)(C)[Si](OC1CCC(N)CC1)(c1ccccc1)c1ccccc1- InChIKey
CHRNWFDNASYVLH-UHFFFAOYSA-N- Molecular formula
- C22H31NOSi
- Average molar mass
- 353.6 g/mol
- Monoisotopic mass
- 353.21749115
Names & identifiers
- Preferred name
- rel-(1R,4r)-4-((tert-butyldiphenylsilyl)oxy)cyclohexan-1-amine
- IUPAC
- 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-amine
- English name
- Cyclohexanamine, 4-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-, cis-
- Molecular formula
- C22H31NOSi
- Molecular weight
- 353.57
Names & synonyms
SCHEMBL14630715SCHEMBL14630717SCHEMBL14840794DTXSID201168819rel-(1R,4r)-4-((tert-butyldiphenylsilyl)oxy)cyclohexan-1-amine1352624-45-3(1s,4s)-4-{[tert-Butyl(diphenyl)silyl]oxy}cyclohexan-1-amineCyclohexanamine, 4-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-, cis-1335139-46-2cis-4-(tert-Butyl-diphenyl-silanyloxy)-cyclohexylamine
Database identifiers
- CAS
1335139-46-2- PubChem CID
- 71222982
- DTXSID
DTXSID201168819
Properties
Computed structural properties
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 381
Physicochemical properties
- Boiling point
- 418.126 · 418.126±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.035 · 1.035±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 10.346 · 10.346±0.70(predicted)
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Related reactions
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Compound notes
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