(Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol

C16H34O2Si — CID 10968145

IUPAC(Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol
SMILESC/C=C\[C@H](C)[C@@H](O)CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C16H34O2Si/c1-9-10-15(8)16(17)11-18-19(12(2)3,13(4)5)14(6)7/h9-10,12-17H,11H2,1-8H3/b10-9-/t15-,16-/m0/s1
InChIKeyZNGXTJPADGWDKD-VNEPOGMYSA-N
MW286.53 g/mol
LogP4.75
Rot. Bonds8

About (Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol

(Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol (PubChem CID 10968145) has the molecular formula C16H34O2Si and a molecular weight of 286.53 g/mol. Its IUPAC name is (Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol.

Molecular Properties

Compound Name(Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol
PubChem CID10968145
Molecular FormulaC16H34O2Si
Molecular Weight286.53 g/mol
Exact Mass286.23
IUPAC Name(Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol
SMILESC/C=C\[C@H](C)[C@@H](O)CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C16H34O2Si/c1-9-10-15(8)16(17)11-18-19(12(2)3,13(4)5)14(6)7/h9-10,12-17H,11H2,1-8H3/b10-9-/t15-,16-/m0/s1
InChIKeyZNGXTJPADGWDKD-VNEPOGMYSA-N
XLogP4.75
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.53
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol?
The IUPAC name of (Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol (CID 10968145) is (Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol.
What is the SMILES notation for (Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol?
The canonical SMILES for (Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol is C/C=C\[C@H](C)[C@@H](O)CO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of (Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol?
The InChIKey is ZNGXTJPADGWDKD-VNEPOGMYSA-N. The full InChI is InChI=1S/C16H34O2Si/c1-9-10-15(8)16(17)11-18-19(12(2)3,13(4)5)14(6)7/h9-10,12-17H,11H2,1-8H3/b10-9-/t15-,16-/m0/s1.
What are the key properties of (Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol?
(Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol has a molecular weight of 286.53 g/mol, XLogP of 4.75, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2R,3S)-3-methyl-1-tri(propan-2-yl)silyloxyhex-4-en-2-ol is sourced from PubChem (CID 10968145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).