[(2S)-2-aminobutoxy](tert-butyl)dimethylsilane

• ChemBase ID: 163263
• Molecular Formular: C10H25NOSi
• Molecular Mass: 203.3971
• Monoisotopic Mass: 203.17054096
• SMILES: C([C@@H](CO[Si](C)(C)C(C)(C)C)N)C
• Canonical SMILES: CC[C@@H](CO[Si](C(C)(C)C)(C)C)N
• InChI: InChI=1S/C10H25NOSi/c1-7-9(11)8-12-13(5,6)10(2,3)4/h9H,7-8,11H2,1-6H3/t9-/m0/s1
• InChIKey: ZHCJQVABVSLUJB-VIFPVBQESA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(2S)-2-aminobutoxy](tert-butyl)dimethylsilane
• IUPAC Traditional name: [(2S)-2-aminobutoxy](tert-butyl)dimethylsilane
• Synonyms: 1-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]-2-butanamine; (S)-1-(tert-Butyldimethylsilyloxy)-2-butanamine

Database IDs

• CAS Number: 157555-74-3
• PubChem SID: 162257398
• PubChem CID: 16079733

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.9944133
• LogD (pH = 7.4): 0.05947021
• Log P: 2.3893
• Molar Refractivity: 55.002 cm^3
• Polarizability: 24.303427 Å^3
• Polar Surface Area: 35.25 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Chloroform; Dichloromethane; DMSO; Methanol
• Apperance: Yellow Liquid