(E)-3-trimethylsilylhex-2-ene-1,4-diol

C9H20O2Si — CID 13183195

IUPAC(E)-3-trimethylsilylhex-2-ene-1,4-diol
SMILESCCC(O)/C(=C\CO)[Si](C)(C)C
InChIInChI=1S/C9H20O2Si/c1-5-8(11)9(6-7-10)12(2,3)4/h6,8,10-11H,5,7H2,1-4H3/b9-6+
InChIKeyAWYRQCDXYCQAQN-RMKNXTFCSA-N
MW188.34 g/mol
LogP1.55
Rot. Bonds4

About (E)-3-trimethylsilylhex-2-ene-1,4-diol

(E)-3-trimethylsilylhex-2-ene-1,4-diol (PubChem CID 13183195) has the molecular formula C9H20O2Si and a molecular weight of 188.34 g/mol. Its IUPAC name is (E)-3-trimethylsilylhex-2-ene-1,4-diol.

Molecular Properties

Compound Name(E)-3-trimethylsilylhex-2-ene-1,4-diol
PubChem CID13183195
Molecular FormulaC9H20O2Si
Molecular Weight188.34 g/mol
Exact Mass188.12
IUPAC Name(E)-3-trimethylsilylhex-2-ene-1,4-diol
SMILESCCC(O)/C(=C\CO)[Si](C)(C)C
InChIInChI=1S/C9H20O2Si/c1-5-8(11)9(6-7-10)12(2,3)4/h6,8,10-11H,5,7H2,1-4H3/b9-6+
InChIKeyAWYRQCDXYCQAQN-RMKNXTFCSA-N
XLogP1.55
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.34
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Cyclopenten-1-ol, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, cis-
CID 10176747
(Z)-8-trimethylsilyloct-5-en-7-yn-4-ol
CID 10797972
(Z)-2-trimethylsilylhept-2-en-1-ol
CID 11745353
(E,4S)-4-[tert-butyl(dimethyl)silyl]oxypent-2-en-1-ol
CID 12194985
(1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol
CID 12935881
(Z)-2-methyl-3-(trimethylsilylmethyl)oct-3-ene-2,7-diol
CID 13508268
(E)-7-trimethylsilylhept-4-en-6-yn-3-ol
CID 130131520
(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
(Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-fluorohex-4-en-3-ol
CID 141121837
(E)-6-[tert-butyl(dimethyl)silyl]oxy-2-methylhex-2-en-1-ol
CID 10562301
(1R,4R)-4-((tert-Butyldimethylsilyl)oxy)cyclopent-2-en-1-ol
CID 10878531

Frequently Asked Questions

What is the IUPAC name of (E)-3-trimethylsilylhex-2-ene-1,4-diol?
The IUPAC name of (E)-3-trimethylsilylhex-2-ene-1,4-diol (CID 13183195) is (E)-3-trimethylsilylhex-2-ene-1,4-diol.
What is the SMILES notation for (E)-3-trimethylsilylhex-2-ene-1,4-diol?
The canonical SMILES for (E)-3-trimethylsilylhex-2-ene-1,4-diol is CCC(O)/C(=C\CO)[Si](C)(C)C.
What is the InChIKey of (E)-3-trimethylsilylhex-2-ene-1,4-diol?
The InChIKey is AWYRQCDXYCQAQN-RMKNXTFCSA-N. The full InChI is InChI=1S/C9H20O2Si/c1-5-8(11)9(6-7-10)12(2,3)4/h6,8,10-11H,5,7H2,1-4H3/b9-6+.
What are the key properties of (E)-3-trimethylsilylhex-2-ene-1,4-diol?
(E)-3-trimethylsilylhex-2-ene-1,4-diol has a molecular weight of 188.34 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-trimethylsilylhex-2-ene-1,4-diol is sourced from PubChem (CID 13183195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).