(Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol

C16H22OSi — CID 56840260

IUPAC(Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol
SMILESCC(C)(O)C#C/C(=C/c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C16H22OSi/c1-16(2,17)12-11-15(18(3,4)5)13-14-9-7-6-8-10-14/h6-10,13,17H,1-5H3/b15-13-
InChIKeyHERPMLCZGSEGJH-SQFISAMPSA-N
MW258.44 g/mol
LogP3.72
Rot. Bonds2

About (Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol

(Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol (PubChem CID 56840260) has the molecular formula C16H22OSi and a molecular weight of 258.44 g/mol. Its IUPAC name is (Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol.

Molecular Properties

Compound Name(Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol
PubChem CID56840260
Molecular FormulaC16H22OSi
Molecular Weight258.44 g/mol
Exact Mass258.14
IUPAC Name(Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol
SMILESCC(C)(O)C#C/C(=C/c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C16H22OSi/c1-16(2,17)12-11-15(18(3,4)5)13-14-9-7-6-8-10-14/h6-10,13,17H,1-5H3/b15-13-
InChIKeyHERPMLCZGSEGJH-SQFISAMPSA-N
XLogP3.72
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.44
LogP ≤ 53.72
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

(E)-4-phenyl-2-trimethylsilylbut-3-en-2-ol
CID 102406299
(2Z)-2-benzylidene-4-[tert-butyl(dimethyl)silyl]-1,1-diphenylbut-3-yn-1-ol
CID 16756347
4-[(3-hydroxy-3-methylbut-1-ynyl)-methyl-phenylsilyl]-2-methylbut-3-yn-2-ol
CID 13211512
tert-butyl-[(E)-3,4-diphenylbut-3-en-1-ynyl]-dimethylsilane
CID 102080744
bis(dihydroxy(diphenyl)phosphanium);2,5-dimethylhex-3-yne-2,5-diol
CID 175697648
(E)-2-[4-[(E)-2-hydroxy-2-trimethylsilylethenyl]phenyl]-1-trimethylsilylethenol
CID 101468148
[(E)-3,4-diphenylbut-3-en-1-ynyl]-trimethylsilane
CID 135024613
(E)-2-methyl-3-phenyl-1-trimethylsilylprop-2-en-1-one
CID 6394466
(2E)-2-benzylidene-3-methylbutane-1,3-diol
CID 15011509
1,4-diphenylbuta-1,3-dien-2-yl(trimethyl)silane
CID 86083751
[(E)-2-bromo-2-methylselanylethenyl]benzene
CID 10989488
tert-butyl-[(Z)-3-(methoxymethyl)-4-phenylbut-3-en-1-ynyl]-dimethylsilane
CID 102296200

Frequently Asked Questions

What is the IUPAC name of (Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol?
The IUPAC name of (Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol (CID 56840260) is (Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol.
What is the SMILES notation for (Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol?
The canonical SMILES for (Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol is CC(C)(O)C#C/C(=C/c1ccccc1)[Si](C)(C)C.
What is the InChIKey of (Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol?
The InChIKey is HERPMLCZGSEGJH-SQFISAMPSA-N. The full InChI is InChI=1S/C16H22OSi/c1-16(2,17)12-11-15(18(3,4)5)13-14-9-7-6-8-10-14/h6-10,13,17H,1-5H3/b15-13-.
What are the key properties of (Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol?
(Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol has a molecular weight of 258.44 g/mol, XLogP of 3.72, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-methyl-6-phenyl-5-trimethylsilylhex-5-en-3-yn-2-ol is sourced from PubChem (CID 56840260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).