(Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol

C12H26O2Si — CID 129403734

IUPAC(Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol
SMILESC[C@H](C/C=C\CO)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H26O2Si/c1-11(9-7-8-10-13)14-15(5,6)12(2,3)4/h7-8,11,13H,9-10H2,1-6H3/b8-7-/t11-/m1/s1
InChIKeyXVQJCIIATZRUJV-SKVAFPRGSA-N
MW230.42 g/mol
LogP3.34
Rot. Bonds5

About (Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol

(Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol (PubChem CID 129403734) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is (Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol.

Molecular Properties

Compound Name(Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol
PubChem CID129403734
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Name(Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol
SMILESC[C@H](C/C=C\CO)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H26O2Si/c1-11(9-7-8-10-13)14-15(5,6)12(2,3)4/h7-8,11,13H,9-10H2,1-6H3/b8-7-/t11-/m1/s1
InChIKeyXVQJCIIATZRUJV-SKVAFPRGSA-N
XLogP3.34
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.34
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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Related Compounds

1-[(Tert-butyldimethylsilyl)oxy]but-3-en-2-ol
CID 10910595
2-Cyclopenten-1-ol, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, cis-
CID 10176747
(3R,4S)-4-[tert-butyl(dimethyl)silyl]oxypent-1-en-3-ol
CID 10900062
(E,4S)-4-[tert-butyl(dimethyl)silyl]oxypent-2-en-1-ol
CID 12194985
(E)-5-[tert-butyl(dimethyl)silyl]oxy-3-methylpent-2-en-1-ol
CID 15748152
(E)-6-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol
CID 10489670
Rel-(1R,4S)-4-((tert-butyldimethylsilyl)oxy)cyclopent-2-en-1-ol
CID 10910904
(1S,4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-ol
CID 11020261
(R)-1-(tert-butyldimethylsilanyloxy)-3-buten-2-ol
CID 14185009
(Z)-5-((tert-butyldimethylsilyl)oxy)pent-2-en-1-ol
CID 15689848
(2Z,4R,5S)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]hepta-2,6-dien-1-ol
CID 134950412
(Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-2-en-1-ol
CID 22236659

Frequently Asked Questions

What is the IUPAC name of (Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol?
The IUPAC name of (Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol (CID 129403734) is (Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol.
What is the SMILES notation for (Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol?
The canonical SMILES for (Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol is C[C@H](C/C=C\CO)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of (Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol?
The InChIKey is XVQJCIIATZRUJV-SKVAFPRGSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-11(9-7-8-10-13)14-15(5,6)12(2,3)4/h7-8,11,13H,9-10H2,1-6H3/b8-7-/t11-/m1/s1.
What are the key properties of (Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol?
(Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol has a molecular weight of 230.42 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol is sourced from PubChem (CID 129403734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).