3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol

C15H32O2Si — CID 70178632

IUPAC3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol
SMILESCC(C)(C)[Si](C)(C)OC1CCCCC1CCCO
InChIInChI=1S/C15H32O2Si/c1-15(2,3)18(4,5)17-14-11-7-6-9-13(14)10-8-12-16/h13-14,16H,6-12H2,1-5H3
InChIKeyNUXFBZRIVLZTGZ-UHFFFAOYSA-N
MW272.50 g/mol
LogP4.34
Rot. Bonds5

About 3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol

3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol (PubChem CID 70178632) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is 3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol.

Molecular Properties

Compound Name3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol
PubChem CID70178632
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Name3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol
SMILESCC(C)(C)[Si](C)(C)OC1CCCCC1CCCO
InChIInChI=1S/C15H32O2Si/c1-15(2,3)18(4,5)17-14-11-7-6-9-13(14)10-8-12-16/h13-14,16H,6-12H2,1-5H3
InChIKeyNUXFBZRIVLZTGZ-UHFFFAOYSA-N
XLogP4.34
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.50
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol?
The IUPAC name of 3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol (CID 70178632) is 3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol.
What is the SMILES notation for 3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol?
The canonical SMILES for 3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol is CC(C)(C)[Si](C)(C)OC1CCCCC1CCCO.
What is the InChIKey of 3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol?
The InChIKey is NUXFBZRIVLZTGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-15(2,3)18(4,5)17-14-11-7-6-9-13(14)10-8-12-16/h13-14,16H,6-12H2,1-5H3.
What are the key properties of 3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol?
3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol has a molecular weight of 272.50 g/mol, XLogP of 4.34, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol is sourced from PubChem (CID 70178632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).