tert-butyl(3-chloropropoxy)dimethylsilane

• ChemBase ID: 294821
• Molecular Formular: C9H21ClOSi
• Molecular Mass: 208.80094
• Monoisotopic Mass: 208.1050195
• SMILES: C[Si](OCCCCl)(C(C)(C)C)C
• Canonical SMILES: ClCCCO[Si](C(C)(C)C)(C)C
• InChI: InChI=1S/C9H21ClOSi/c1-9(2,3)12(4,5)11-8-6-7-10/h6-8H2,1-5H3
• InChIKey: LROUBCOBLAPPAT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tert-butyl(3-chloropropoxy)dimethylsilane
• IUPAC Traditional name: tert-butyl(3-chloropropoxy)dimethylsilane
• Synonyms: tert-Butyl(3-chloropropoxy)dimethylsilane

Database IDs

• CAS Number: 89031-82-3
• MDL Number: MFCDN/A99N/A9983
• PubChem SID: 180680352
• PubChem CID: 11009160

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 3.0539
• LogD (pH = 7.4): 3.0539
• Log P: 3.0539
• Molar Refractivity: 52.3181 cm^3
• Polarizability: 22.75105 Å^3
• Polar Surface Area: 9.23 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%