hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane

C13H28O2Si — CID 10705491

IUPAChydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane
SMILESC=CCC(C)OC(CCCCC)[Si](C)(C)O
InChIInChI=1S/C13H28O2Si/c1-6-8-9-11-13(16(4,5)14)15-12(3)10-7-2/h7,12-14H,2,6,8-11H2,1,3-5H3
InChIKeyLRFZJORMCLFUGG-UHFFFAOYSA-N
MW244.45 g/mol
LogP3.65
Rot. Bonds9

About hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane

hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane (PubChem CID 10705491) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane.

Molecular Properties

Compound Namehydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane
PubChem CID10705491
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Namehydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane
SMILESC=CCC(C)OC(CCCCC)[Si](C)(C)O
InChIInChI=1S/C13H28O2Si/c1-6-8-9-11-13(16(4,5)14)15-12(3)10-7-2/h7,12-14H,2,6,8-11H2,1,3-5H3
InChIKeyLRFZJORMCLFUGG-UHFFFAOYSA-N
XLogP3.65
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-dimethyl-[(2S)-1-[(2S)-oxiran-2-yl]pent-4-en-2-yl]oxysilane
CID 10332001
tert-butyl-dimethyl-[(2R)-1-[(2R)-oxiran-2-yl]pent-4-en-2-yl]oxysilane
CID 10705360
tert-butyl-dimethyl-[(2S)-1-[(2R)-oxiran-2-yl]pent-4-en-2-yl]oxysilane
CID 11564984
tert-butyl-dimethyl-[(2R)-1-[(2S)-oxiran-2-yl]pent-4-en-2-yl]oxysilane
CID 13895986
tert-butyl-dimethyl-[(3S,5R)-5-prop-2-enyloxolan-3-yl]oxysilane
CID 101748377
(4S)-4-[tert-butyl(dimethyl)silyl]oxyhept-6-en-1-ol
CID 134858233
tert-butyl-dimethyl-[(3S,5S)-5-prop-2-enyloxolan-3-yl]oxysilane
CID 134996026
fluoro-dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]silane
CID 10848054
Triethyl(hept-1-en-4-yloxy)silane
CID 53922362
1-Methoxyhex-5-en-3-yloxy(trimethyl)silane
CID 57057310
Triethyl(oct-1-en-4-yloxy)silane
CID 57245587
[(3S)-1-butoxyhex-5-en-3-yl]oxy-tert-butyl-dimethylsilane
CID 89568387

Frequently Asked Questions

What is the IUPAC name of hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane?
The IUPAC name of hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane (CID 10705491) is hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane.
What is the SMILES notation for hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane?
The canonical SMILES for hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane is C=CCC(C)OC(CCCCC)[Si](C)(C)O.
What is the InChIKey of hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane?
The InChIKey is LRFZJORMCLFUGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-6-8-9-11-13(16(4,5)14)15-12(3)10-7-2/h7,12-14H,2,6,8-11H2,1,3-5H3.
What are the key properties of hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane?
hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane has a molecular weight of 244.45 g/mol, XLogP of 3.65, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-dimethyl-(1-pent-4-en-2-yloxyhexyl)silane is sourced from PubChem (CID 10705491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).