(E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol

C13H20OSi — CID 102406299

IUPAC(E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol
SMILESCC(O)(/C=C/c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C13H20OSi/c1-13(14,15(2,3)4)11-10-12-8-6-5-7-9-12/h5-11,14H,1-4H3/b11-10+
InChIKeyWXEQAVYTQJXKSE-ZHACJKMWSA-N
MW220.39 g/mol
LogP3.33
Rot. Bonds3

About (E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol

(E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol (PubChem CID 102406299) has the molecular formula C13H20OSi and a molecular weight of 220.39 g/mol. Its IUPAC name is (E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol.

Molecular Properties

Compound Name(E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol
PubChem CID102406299
Molecular FormulaC13H20OSi
Molecular Weight220.39 g/mol
Exact Mass220.13
IUPAC Name(E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol
SMILESCC(O)(/C=C/c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C13H20OSi/c1-13(14,15(2,3)4)11-10-12-8-6-5-7-9-12/h5-11,14H,1-4H3/b11-10+
InChIKeyWXEQAVYTQJXKSE-ZHACJKMWSA-N
XLogP3.33
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.39
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(Z)-3-methyl-1-phenylpent-1-en-3-ol
CID 20841410
(Z)-1,1,3-triphenylprop-2-en-1-ol
CID 92856099
(1E,4Z)-3-[2-[tert-butyl(dimethyl)silyl]ethynyl]-1-phenylhexa-1,4-dien-3-ol
CID 101446464
(1E)-3-[2-[tert-butyl(dimethyl)silyl]ethynyl]-1-phenylhexa-1,4-dien-3-ol
CID 134940588
(E)-1,1,1-trifluoro-4-phenylbut-3-ene-2,2-diol
CID 89384206
3,3-dimethylbut-1-enylbenzene;1,2-xylene
CID 173385889
(E)-2-ethenyl-2-methyl-4-phenylbut-3-enoic acid
CID 13110783
(1E)-3,7-dimethyl-1-phenylocta-1,6-dien-3-ol
CID 102331982
trimethyl-[(Z)-1,1,3-triphenylprop-2-enoxy]silane
CID 11233667
3,3-dicyclopropylbut-1-enylbenzene
CID 173296746
ethyl 3-hydroxy-3-methyl-5-phenylpent-4-enoate
CID 66650377
[(Z,2S)-2-ethyl-2-methyl-4-phenylbut-3-enyl]-dimethyl-phenylsilane
CID 134835375

Frequently Asked Questions

What is the IUPAC name of (E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol?
The IUPAC name of (E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol (CID 102406299) is (E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol.
What is the SMILES notation for (E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol?
The canonical SMILES for (E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol is CC(O)(/C=C/c1ccccc1)[Si](C)(C)C.
What is the InChIKey of (E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol?
The InChIKey is WXEQAVYTQJXKSE-ZHACJKMWSA-N. The full InChI is InChI=1S/C13H20OSi/c1-13(14,15(2,3)4)11-10-12-8-6-5-7-9-12/h5-11,14H,1-4H3/b11-10+.
What are the key properties of (E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol?
(E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol has a molecular weight of 220.39 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol is sourced from PubChem (CID 102406299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).