4-trimethylsilylhex-5-en-3-ol

C9H20OSi — CID 12793718

IUPAC4-trimethylsilylhex-5-en-3-ol
SMILESC=CC(C(O)CC)[Si](C)(C)C
InChIInChI=1S/C9H20OSi/c1-6-8(10)9(7-2)11(3,4)5/h7-10H,2,6H2,1,3-5H3
InChIKeyKCOHVBWMPDVTCP-UHFFFAOYSA-N
MW172.34 g/mol
LogP2.65
Rot. Bonds4

About 4-trimethylsilylhex-5-en-3-ol

4-trimethylsilylhex-5-en-3-ol (PubChem CID 12793718) has the molecular formula C9H20OSi and a molecular weight of 172.34 g/mol. Its IUPAC name is 4-trimethylsilylhex-5-en-3-ol.

Molecular Properties

Compound Name4-trimethylsilylhex-5-en-3-ol
PubChem CID12793718
Molecular FormulaC9H20OSi
Molecular Weight172.34 g/mol
Exact Mass172.13
IUPAC Name4-trimethylsilylhex-5-en-3-ol
SMILESC=CC(C(O)CC)[Si](C)(C)C
InChIInChI=1S/C9H20OSi/c1-6-8(10)9(7-2)11(3,4)5/h7-10H,2,6H2,1,3-5H3
InChIKeyKCOHVBWMPDVTCP-UHFFFAOYSA-N
XLogP2.65
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.34
LogP ≤ 52.65
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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Related Compounds

4-(Tert-butyldimethylsiloxy)-1,6-heptadiene
CID 10933202
(Z)-4-(Trimethylsilyl)but-3-en-1-ol
CID 5386726
Tert-butyl-hex-5-en-3-yloxy-dimethylsilane
CID 15358394
(Z)-5-trimethylsilylpent-4-en-2-ol
CID 11480588
(E)-2-methyl-6-trimethylsilylhex-5-en-3-ol
CID 13263808
3-[Tert-butyl(dimethyl)silyl]oxyhex-5-en-1-ol
CID 85798469
(E)-4-trimethylsilylbut-3-en-1-ol
CID 5901592
(E)-4-triethylsilylbut-3-en-1-ol
CID 10419938
(2S)-4-(trimethylsilylmethyl)pent-4-en-2-ol
CID 10877610
5-Hexen-3-ol, 1-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-
CID 10988080
1-Trimethylsilylpent-4-en-1-ol
CID 12887657
1-Trimethylsilylbut-3-en-1-ol
CID 130152388

Frequently Asked Questions

What is the IUPAC name of 4-trimethylsilylhex-5-en-3-ol?
The IUPAC name of 4-trimethylsilylhex-5-en-3-ol (CID 12793718) is 4-trimethylsilylhex-5-en-3-ol.
What is the SMILES notation for 4-trimethylsilylhex-5-en-3-ol?
The canonical SMILES for 4-trimethylsilylhex-5-en-3-ol is C=CC(C(O)CC)[Si](C)(C)C.
What is the InChIKey of 4-trimethylsilylhex-5-en-3-ol?
The InChIKey is KCOHVBWMPDVTCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20OSi/c1-6-8(10)9(7-2)11(3,4)5/h7-10H,2,6H2,1,3-5H3.
What are the key properties of 4-trimethylsilylhex-5-en-3-ol?
4-trimethylsilylhex-5-en-3-ol has a molecular weight of 172.34 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-trimethylsilylhex-5-en-3-ol is sourced from PubChem (CID 12793718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).