[4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol

C13H28O2Si — CID 173195755

IUPAC[4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol
SMILESC[SiH2]OC(C1CCC(CO)CC1)C(C)(C)C
InChIInChI=1S/C13H28O2Si/c1-13(2,3)12(15-16-4)11-7-5-10(9-14)6-8-11/h10-12,14H,5-9,16H2,1-4H3
InChIKeyYHQCJINHBQGXPX-UHFFFAOYSA-N
MW244.45 g/mol
LogP2.35
Rot. Bonds4

About [4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol

[4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol (PubChem CID 173195755) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is [4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol.

Molecular Properties

Compound Name[4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol
PubChem CID173195755
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Name[4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol
SMILESC[SiH2]OC(C1CCC(CO)CC1)C(C)(C)C
InChIInChI=1S/C13H28O2Si/c1-13(2,3)12(15-16-4)11-7-5-10(9-14)6-8-11/h10-12,14H,5-9,16H2,1-4H3
InChIKeyYHQCJINHBQGXPX-UHFFFAOYSA-N
XLogP2.35
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 52.35
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 [4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol?
The IUPAC name of [4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol (CID 173195755) is [4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol.
What is the SMILES notation for [4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol?
The canonical SMILES for [4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol is C[SiH2]OC(C1CCC(CO)CC1)C(C)(C)C.
What is the InChIKey of [4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol?
The InChIKey is YHQCJINHBQGXPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-13(2,3)12(15-16-4)11-7-5-10(9-14)6-8-11/h10-12,14H,5-9,16H2,1-4H3.
What are the key properties of [4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol?
[4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol has a molecular weight of 244.45 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,2-dimethyl-1-methylsilyloxypropyl)cyclohexyl]methanol is sourced from PubChem (CID 173195755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).