2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol

C15H32O2Si — CID 19966072

IUPAC2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol
SMILESCC(C)(C)[Si](C)(C)OC(CO)CC1CCCCC1
InChIInChI=1S/C15H32O2Si/c1-15(2,3)18(4,5)17-14(12-16)11-13-9-7-6-8-10-13/h13-14,16H,6-12H2,1-5H3
InChIKeyXOWZIBSVLWVJOV-UHFFFAOYSA-N
MW272.50 g/mol
LogP4.34
Rot. Bonds5

About 2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol

2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol (PubChem CID 19966072) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is 2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol.

Molecular Properties

Compound Name2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol
PubChem CID19966072
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Name2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol
SMILESCC(C)(C)[Si](C)(C)OC(CO)CC1CCCCC1
InChIInChI=1S/C15H32O2Si/c1-15(2,3)18(4,5)17-14(12-16)11-13-9-7-6-8-10-13/h13-14,16H,6-12H2,1-5H3
InChIKeyXOWZIBSVLWVJOV-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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Related Compounds

1-[tert-butyl(dimethyl)silyl]oxy-1-cyclohexylpropan-2-ol
CID 166437528
(2R)-2-[tert-butyl(dimethyl)silyl]oxyhex-5-yn-1-ol
CID 121013901
[4-[1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclohexyl]methanol
CID 22106813
[(2S)-4-amino-3-[tert-butyl(dimethyl)silyl]oxy-1-cyclohexylbutan-2-yl]carbamic acid
CID 67852615
tert-butyl-[(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-1,4-bis(cyclohexylsulfanyl)butan-2-yl]oxy-dimethylsilane
CID 101186688
ethyl 2-[tert-butyl(dimethyl)silyl]oxy-6-cyclohexylhex-4-enoate
CID 57108378
tert-butyl-[(E,1S,2S)-2-[tert-butyl(dimethyl)silyl]oxy-1-cyclohexylpent-3-enoxy]-dimethylsilane
CID 10693040
tert-butyl 2-amino-3-cyclohexylpropanoate
CID 20814860
tert-butyl-(1-cyclopropylethoxy)-dimethylsilane
CID 22391705
tert-butyl N-[(2R)-2-[tert-butyl(dimethyl)silyl]oxy-3-hydroxypropyl]carbamate
CID 140880873
tert-butyl N-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-3-hydroxypropyl]carbamate
CID 140880863
methyl (E,5R)-5-[tert-butyl(dimethyl)silyl]oxy-5-cyclohexyl-3-methylpent-2-enoate
CID 134943935

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol?
The IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol (CID 19966072) is 2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol.
What is the SMILES notation for 2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol?
The canonical SMILES for 2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol is CC(C)(C)[Si](C)(C)OC(CO)CC1CCCCC1.
What is the InChIKey of 2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol?
The InChIKey is XOWZIBSVLWVJOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-15(2,3)18(4,5)17-14(12-16)11-13-9-7-6-8-10-13/h13-14,16H,6-12H2,1-5H3.
What are the key properties of 2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol?
2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-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 2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol is sourced from PubChem (CID 19966072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).