6-trimethylsilylhex-1-en-5-yn-3-ol

C9H16OSi — CID 15049157

IUPAC6-trimethylsilylhex-1-en-5-yn-3-ol
SMILESC=CC(O)CC#C[Si](C)(C)C
InChIInChI=1S/C9H16OSi/c1-5-9(10)7-6-8-11(2,3)4/h5,9-10H,1,7H2,2-4H3
InChIKeyLBYJASJYVBUITM-UHFFFAOYSA-N
MW168.31 g/mol
LogP1.80
Rot. Bonds2

About 6-trimethylsilylhex-1-en-5-yn-3-ol

6-trimethylsilylhex-1-en-5-yn-3-ol (PubChem CID 15049157) has the molecular formula C9H16OSi and a molecular weight of 168.31 g/mol. Its IUPAC name is 6-trimethylsilylhex-1-en-5-yn-3-ol.

Molecular Properties

Compound Name6-trimethylsilylhex-1-en-5-yn-3-ol
PubChem CID15049157
Molecular FormulaC9H16OSi
Molecular Weight168.31 g/mol
Exact Mass168.10
IUPAC Name6-trimethylsilylhex-1-en-5-yn-3-ol
SMILESC=CC(O)CC#C[Si](C)(C)C
InChIInChI=1S/C9H16OSi/c1-5-9(10)7-6-8-11(2,3)4/h5,9-10H,1,7H2,2-4H3
InChIKeyLBYJASJYVBUITM-UHFFFAOYSA-N
XLogP1.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.31
LogP ≤ 51.80
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

5-(Trimethylsilyl)pent-1-en-4-yn-3-ol
CID 19917033
(+/-)-trans-4-(Trimethylsilyl)-3-buten-2-ol
CID 10351819
(E)-3-fluoro-1-tri(propan-2-yl)silylhept-5-en-1-yn-4-ol
CID 10517217
(Z)-5-trimethylsilylpent-4-en-2-ol
CID 11480588
3-Buten-2-ol, 4-(trimethylsilyl)-
CID 53756305
(3S,5R)-7-(Trimethylsilyl)hept-1-en-6-yne-3,5-diol
CID 56924135
1-Tri(propan-2-yl)silylhex-5-en-1-yn-3-ol
CID 10515006
(Z)-8-trimethylsilyloct-5-en-7-yn-4-ol
CID 10797972
(4S)-7-trimethylsilylhept-1-en-6-yn-4-ol
CID 10921159
1-Trimethylsilylhept-6-en-1-yn-3-ol
CID 11137772
(3S)-1-tri(propan-2-yl)silylhex-5-en-1-yn-3-ol
CID 11230515
1-Trimethylsilylhex-5-en-1-yn-3-ol
CID 11263728

Frequently Asked Questions

What is the IUPAC name of 6-trimethylsilylhex-1-en-5-yn-3-ol?
The IUPAC name of 6-trimethylsilylhex-1-en-5-yn-3-ol (CID 15049157) is 6-trimethylsilylhex-1-en-5-yn-3-ol.
What is the SMILES notation for 6-trimethylsilylhex-1-en-5-yn-3-ol?
The canonical SMILES for 6-trimethylsilylhex-1-en-5-yn-3-ol is C=CC(O)CC#C[Si](C)(C)C.
What is the InChIKey of 6-trimethylsilylhex-1-en-5-yn-3-ol?
The InChIKey is LBYJASJYVBUITM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16OSi/c1-5-9(10)7-6-8-11(2,3)4/h5,9-10H,1,7H2,2-4H3.
What are the key properties of 6-trimethylsilylhex-1-en-5-yn-3-ol?
6-trimethylsilylhex-1-en-5-yn-3-ol has a molecular weight of 168.31 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-trimethylsilylhex-1-en-5-yn-3-ol is sourced from PubChem (CID 15049157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).