(3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol

C16H32OSi3 — CID 166442571

IUPAC(3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol
SMILESCC[C@@](O)(C#C[Si](C)(C)C)[Si](C)(C)CC#C[Si](C)(C)C
InChIInChI=1S/C16H32OSi3/c1-10-16(17,12-15-19(5,6)7)20(8,9)14-11-13-18(2,3)4/h17H,10,14H2,1-9H3/t16-/m0/s1
InChIKeyVNWCLFBYOLKHCV-INIZCTEOSA-N
MW324.69 g/mol
LogP4.14
Rot. Bonds3

About (3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol

(3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol (PubChem CID 166442571) has the molecular formula C16H32OSi3 and a molecular weight of 324.69 g/mol. Its IUPAC name is (3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol.

Molecular Properties

Compound Name(3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol
PubChem CID166442571
Molecular FormulaC16H32OSi3
Molecular Weight324.69 g/mol
Exact Mass324.18
IUPAC Name(3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol
SMILESCC[C@@](O)(C#C[Si](C)(C)C)[Si](C)(C)CC#C[Si](C)(C)C
InChIInChI=1S/C16H32OSi3/c1-10-16(17,12-15-19(5,6)7)20(8,9)14-11-13-18(2,3)4/h17H,10,14H2,1-9H3/t16-/m0/s1
InChIKeyVNWCLFBYOLKHCV-INIZCTEOSA-N
XLogP4.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.69
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3,3-Difluoro-2-trimethylsilyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol
CID 134846991
1,7-Bis[tri(propan-2-yl)silyl]-3-[2-tri(propan-2-yl)silylethynyl]hepta-1,4,6-triyn-3-ol
CID 15258550
(3R)-3-ethynyl-1-trimethylsilyl-5-tri(propan-2-yl)silylpenta-1,4-diyn-3-ol
CID 135086314
2,4-Bis(trimethylsilyl)but-3-yn-2-ol
CID 15121706
2-[Tert-butyl(dimethyl)silyl]-4-trimethylsilylbut-3-yn-2-ol
CID 135068800
1,4-Bis-triethylsilyl-3-butyn-1-ol
CID 19358398
Bis triethylsilyl butynol
CID 23374723
1,1-Bis(triethylsilyl)but-3-yn-1-ol
CID 87941302
3,3-Bis(trimethylsilyl)but-1-yn-1-ol
CID 87941498
3-Ethynyl-1-trimethylsilyl-5-tri(propan-2-yl)silylpenta-1,4-diyn-3-ol
CID 11371003
(2R)-2-trimethylsilylpent-4-yn-2-ol
CID 11955075
1-Triethylsilyl-3-(2-trimethylsilylethynyl)-5-tri(propan-2-yl)silylpenta-1,4-diyn-3-ol
CID 12036884

Frequently Asked Questions

What is the IUPAC name of (3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol?
The IUPAC name of (3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol (CID 166442571) is (3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol.
What is the SMILES notation for (3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol?
The canonical SMILES for (3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol is CC[C@@](O)(C#C[Si](C)(C)C)[Si](C)(C)CC#C[Si](C)(C)C.
What is the InChIKey of (3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol?
The InChIKey is VNWCLFBYOLKHCV-INIZCTEOSA-N. The full InChI is InChI=1S/C16H32OSi3/c1-10-16(17,12-15-19(5,6)7)20(8,9)14-11-13-18(2,3)4/h17H,10,14H2,1-9H3/t16-/m0/s1.
What are the key properties of (3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol?
(3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol has a molecular weight of 324.69 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-[dimethyl(3-trimethylsilylprop-2-ynyl)silyl]-1-trimethylsilylpent-1-yn-3-ol is sourced from PubChem (CID 166442571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).