chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane

C19H37ClSi — CID 54485086

IUPACchloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane
SMILESC[Si](C)(Cl)CC1CCCCCCC=CCCCCCCC1
InChIInChI=1S/C19H37ClSi/c1-21(2,20)18-19-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19/h3-4,19H,5-18H2,1-2H3
InChIKeyXRSOLBHHZCNKGL-UHFFFAOYSA-N
MW329.04 g/mol
LogP7.69
Rot. Bonds2

About chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane

chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane (PubChem CID 54485086) has the molecular formula C19H37ClSi and a molecular weight of 329.04 g/mol. Its IUPAC name is chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane.

Molecular Properties

Compound Namechloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane
PubChem CID54485086
Molecular FormulaC19H37ClSi
Molecular Weight329.04 g/mol
Exact Mass328.24
IUPAC Namechloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane
SMILESC[Si](C)(Cl)CC1CCCCCCC=CCCCCCCC1
InChIInChI=1S/C19H37ClSi/c1-21(2,20)18-19-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19/h3-4,19H,5-18H2,1-2H3
InChIKeyXRSOLBHHZCNKGL-UHFFFAOYSA-N
XLogP7.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.04
LogP ≤ 57.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(1E)-4-ethylcyclononene
CID 173294851
(1Z)-5-ethylcyclononene
CID 173295229
9-methylcyclopentadecene
CID 154291341
chloro-(2-cyclopentylethyl)-dimethylsilane
CID 166025273
cyclododecene;cyclohexylcyclohexane
CID 173310836
(1Z)-6-chlorocyclopentadecene
CID 138480861
(8Z)-17-oxabicyclo[14.1.0]heptadec-8-ene
CID 19838536
(16S)-17-oxabicyclo[14.1.0]heptadec-8-ene
CID 173496111
cyclohexene;cyclopentane;propane
CID 142184271
(1Z,9E,17E)-cyclotetracosa-1,9,17-triene
CID 153422638
(1E)-cyclooctadeca-1,8-diene
CID 173129359
cyclopentadecene
CID 5463009

Frequently Asked Questions

What is the IUPAC name of chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane?
The IUPAC name of chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane (CID 54485086) is chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane.
What is the SMILES notation for chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane?
The canonical SMILES for chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane is C[Si](C)(Cl)CC1CCCCCCC=CCCCCCCC1.
What is the InChIKey of chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane?
The InChIKey is XRSOLBHHZCNKGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H37ClSi/c1-21(2,20)18-19-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19/h3-4,19H,5-18H2,1-2H3.
What are the key properties of chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane?
chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane has a molecular weight of 329.04 g/mol, XLogP of 7.69, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(cyclohexadec-8-en-1-ylmethyl)-dimethylsilane is sourced from PubChem (CID 54485086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).