1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol

C12H22OSi — CID 12653264

IUPAC1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol
SMILESC=C=C(C1(O)CCCCC1)[Si](C)(C)C
InChIInChI=1S/C12H22OSi/c1-5-11(14(2,3)4)12(13)9-7-6-8-10-12/h13H,1,6-10H2,2-4H3
InChIKeyCIFWZZLKXHEJQC-UHFFFAOYSA-N
MW210.39 g/mol
LogP3.27
Rot. Bonds2

About 1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol

1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol (PubChem CID 12653264) has the molecular formula C12H22OSi and a molecular weight of 210.39 g/mol. Its IUPAC name is 1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol
PubChem CID12653264
Molecular FormulaC12H22OSi
Molecular Weight210.39 g/mol
Exact Mass210.14
IUPAC Name1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol
SMILESC=C=C(C1(O)CCCCC1)[Si](C)(C)C
InChIInChI=1S/C12H22OSi/c1-5-11(14(2,3)4)12(13)9-7-6-8-10-12/h13H,1,6-10H2,2-4H3
InChIKeyCIFWZZLKXHEJQC-UHFFFAOYSA-N
XLogP3.27
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.39
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol?
The IUPAC name of 1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol (CID 12653264) is 1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol.
What is the SMILES notation for 1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol?
The canonical SMILES for 1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol is C=C=C(C1(O)CCCCC1)[Si](C)(C)C.
What is the InChIKey of 1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol?
The InChIKey is CIFWZZLKXHEJQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22OSi/c1-5-11(14(2,3)4)12(13)9-7-6-8-10-12/h13H,1,6-10H2,2-4H3.
What are the key properties of 1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol?
1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol has a molecular weight of 210.39 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-trimethylsilylpropa-1,2-dienyl)cyclohexan-1-ol is sourced from PubChem (CID 12653264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).