(1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol

C14H26OSi — CID 10586052

IUPAC(1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol
SMILESCC=C=C([C@H](O)C1CCCCC1)[Si](C)(C)C
InChIInChI=1S/C14H26OSi/c1-5-9-13(16(2,3)4)14(15)12-10-7-6-8-11-12/h5,12,14-15H,6-8,10-11H2,1-4H3/t9?,14-/m1/s1
InChIKeyQYIWHPYAVBZDHR-IWSPRGBSSA-N
MW238.45 g/mol
LogP3.91
Rot. Bonds3

About (1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol

(1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol (PubChem CID 10586052) has the molecular formula C14H26OSi and a molecular weight of 238.45 g/mol. Its IUPAC name is (1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol.

Molecular Properties

Compound Name(1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol
PubChem CID10586052
Molecular FormulaC14H26OSi
Molecular Weight238.45 g/mol
Exact Mass238.18
IUPAC Name(1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol
SMILESCC=C=C([C@H](O)C1CCCCC1)[Si](C)(C)C
InChIInChI=1S/C14H26OSi/c1-5-9-13(16(2,3)4)14(15)12-10-7-6-8-11-12/h5,12,14-15H,6-8,10-11H2,1-4H3/t9?,14-/m1/s1
InChIKeyQYIWHPYAVBZDHR-IWSPRGBSSA-N
XLogP3.91
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.45
LogP ≤ 53.91
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 (1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol?
The IUPAC name of (1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol (CID 10586052) is (1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol.
What is the SMILES notation for (1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol?
The canonical SMILES for (1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol is CC=C=C([C@H](O)C1CCCCC1)[Si](C)(C)C.
What is the InChIKey of (1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol?
The InChIKey is QYIWHPYAVBZDHR-IWSPRGBSSA-N. The full InChI is InChI=1S/C14H26OSi/c1-5-9-13(16(2,3)4)14(15)12-10-7-6-8-11-12/h5,12,14-15H,6-8,10-11H2,1-4H3/t9?,14-/m1/s1.
What are the key properties of (1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol?
(1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol has a molecular weight of 238.45 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol is sourced from PubChem (CID 10586052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).