trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol

C12H24OSi — CID 14203372

IUPACtrans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol
SMILESC=CC([C@@H]1CCCC[C@H]1O)[Si](C)(C)C
InChIInChI=1S/C12H24OSi/c1-5-12(14(2,3)4)10-8-6-7-9-11(10)13/h5,10-13H,1,6-9H2,2-4H3/t10-,11-,12?/m1/s1
InChIKeyNVMHTEYQRZXXBD-XFKKCKKNSA-N
MW212.41 g/mol
LogP3.43
Rot. Bonds3

About trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol

trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol (PubChem CID 14203372) has the molecular formula C12H24OSi and a molecular weight of 212.41 g/mol. Its IUPAC name is trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol
PubChem CID14203372
Molecular FormulaC12H24OSi
Molecular Weight212.41 g/mol
Exact Mass212.16
IUPAC Nametrans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol
SMILESC=CC([C@@H]1CCCC[C@H]1O)[Si](C)(C)C
InChIInChI=1S/C12H24OSi/c1-5-12(14(2,3)4)10-8-6-7-9-11(10)13/h5,10-13H,1,6-9H2,2-4H3/t10-,11-,12?/m1/s1
InChIKeyNVMHTEYQRZXXBD-XFKKCKKNSA-N
XLogP3.43
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.41
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol?
The IUPAC name of trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol (CID 14203372) is trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol.
What is the SMILES notation for trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol?
The canonical SMILES for trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol is C=CC([C@@H]1CCCC[C@H]1O)[Si](C)(C)C.
What is the InChIKey of trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol?
The InChIKey is NVMHTEYQRZXXBD-XFKKCKKNSA-N. The full InChI is InChI=1S/C12H24OSi/c1-5-12(14(2,3)4)10-8-6-7-9-11(10)13/h5,10-13H,1,6-9H2,2-4H3/t10-,11-,12?/m1/s1.
What are the key properties of trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol?
trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol has a molecular weight of 212.41 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-(1-trimethylsilylprop-2-enyl)cyclohexan-1-ol is sourced from PubChem (CID 14203372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).