(Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol

C20H40OSi — CID 10925397

IUPAC(Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol
SMILESCCCCCC/C(=C/[C@@H](C)[C@@H](O)C1CCCCC1)[Si](C)(C)C
InChIInChI=1S/C20H40OSi/c1-6-7-8-12-15-19(22(3,4)5)16-17(2)20(21)18-13-10-9-11-14-18/h16-18,20-21H,6-15H2,1-5H3/b19-16-/t17-,20-/m1/s1
InChIKeyCDHHLJTXNULVBV-CXRPIFAHSA-N
MW324.63 g/mol
LogP6.34
Rot. Bonds9

About (Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol

(Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol (PubChem CID 10925397) has the molecular formula C20H40OSi and a molecular weight of 324.63 g/mol. Its IUPAC name is (Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol.

Molecular Properties

Compound Name(Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol
PubChem CID10925397
Molecular FormulaC20H40OSi
Molecular Weight324.63 g/mol
Exact Mass324.28
IUPAC Name(Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol
SMILESCCCCCC/C(=C/[C@@H](C)[C@@H](O)C1CCCCC1)[Si](C)(C)C
InChIInChI=1S/C20H40OSi/c1-6-7-8-12-15-19(22(3,4)5)16-17(2)20(21)18-13-10-9-11-14-18/h16-18,20-21H,6-15H2,1-5H3/b19-16-/t17-,20-/m1/s1
InChIKeyCDHHLJTXNULVBV-CXRPIFAHSA-N
XLogP6.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.63
LogP ≤ 56.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol?
The IUPAC name of (Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol (CID 10925397) is (Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol.
What is the SMILES notation for (Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol?
The canonical SMILES for (Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol is CCCCCC/C(=C/[C@@H](C)[C@@H](O)C1CCCCC1)[Si](C)(C)C.
What is the InChIKey of (Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol?
The InChIKey is CDHHLJTXNULVBV-CXRPIFAHSA-N. The full InChI is InChI=1S/C20H40OSi/c1-6-7-8-12-15-19(22(3,4)5)16-17(2)20(21)18-13-10-9-11-14-18/h16-18,20-21H,6-15H2,1-5H3/b19-16-/t17-,20-/m1/s1.
What are the key properties of (Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol?
(Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol has a molecular weight of 324.63 g/mol, XLogP of 6.34, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,1S,2R)-1-cyclohexyl-2-methyl-4-trimethylsilyldec-3-en-1-ol is sourced from PubChem (CID 10925397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).