1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol

C14H28OSi — CID 15049560

IUPAC1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol
SMILESC=C(C)C(C[Si](C)(C)C)C1(O)CCCCC1
InChIInChI=1S/C14H28OSi/c1-12(2)13(11-16(3,4)5)14(15)9-7-6-8-10-14/h13,15H,1,6-11H2,2-5H3
InChIKeyNCZHVYNJTLXECK-UHFFFAOYSA-N
MW240.46 g/mol
LogP4.21
Rot. Bonds4

About 1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol

1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol (PubChem CID 15049560) has the molecular formula C14H28OSi and a molecular weight of 240.46 g/mol. Its IUPAC name is 1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol
PubChem CID15049560
Molecular FormulaC14H28OSi
Molecular Weight240.46 g/mol
Exact Mass240.19
IUPAC Name1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol
SMILESC=C(C)C(C[Si](C)(C)C)C1(O)CCCCC1
InChIInChI=1S/C14H28OSi/c1-12(2)13(11-16(3,4)5)14(15)9-7-6-8-10-14/h13,15H,1,6-11H2,2-5H3
InChIKeyNCZHVYNJTLXECK-UHFFFAOYSA-N
XLogP4.21
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.46
LogP ≤ 54.21
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 1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol?
The IUPAC name of 1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol (CID 15049560) is 1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol.
What is the SMILES notation for 1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol?
The canonical SMILES for 1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol is C=C(C)C(C[Si](C)(C)C)C1(O)CCCCC1.
What is the InChIKey of 1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol?
The InChIKey is NCZHVYNJTLXECK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28OSi/c1-12(2)13(11-16(3,4)5)14(15)9-7-6-8-10-14/h13,15H,1,6-11H2,2-5H3.
What are the key properties of 1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol?
1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol has a molecular weight of 240.46 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-1-trimethylsilylbut-3-en-2-yl)cyclohexan-1-ol is sourced from PubChem (CID 15049560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).