(6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol

C28H50O2Si — CID 134875012

IUPAC(6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/C(CC#CCO)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C28H50O2Si/c1-22(2)15-13-16-26(9)17-14-18-27(10)21-28(19-11-12-20-29)30-31(23(3)4,24(5)6)25(7)8/h15,17,21,23-25,28-29H,13-14,16,18-20H2,1-10H3/b26-17+,27-21+
InChIKeyIXZONFAPIWOLKR-WZGXYAEVSA-N
MW446.79 g/mol
LogP8.35
Rot. Bonds13

About (6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol

(6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol (PubChem CID 134875012) has the molecular formula C28H50O2Si and a molecular weight of 446.79 g/mol. Its IUPAC name is (6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol.

Molecular Properties

Compound Name(6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol
PubChem CID134875012
Molecular FormulaC28H50O2Si
Molecular Weight446.79 g/mol
Exact Mass446.36
IUPAC Name(6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/C(CC#CCO)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C28H50O2Si/c1-22(2)15-13-16-26(9)17-14-18-27(10)21-28(19-11-12-20-29)30-31(23(3)4,24(5)6)25(7)8/h15,17,21,23-25,28-29H,13-14,16,18-20H2,1-10H3/b26-17+,27-21+
InChIKeyIXZONFAPIWOLKR-WZGXYAEVSA-N
XLogP8.35
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.79
LogP ≤ 58.35
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze (6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4E)-5-methyl-8-triethylsilyloxy-2-(trimethylsilylmethyl)octa-1,4-dien-3-ol
CID 134832873
(2E,6E)-8-[tert-butyl(dimethyl)silyl]oxy-3,7-dimethylocta-2,6-dien-1-ol
CID 13618185
(2E,4S)-1-[tert-butyl(dimethyl)silyl]oxy-3,7-dimethylocta-2,6-dien-4-ol
CID 11098093
18-[(E)-1-[tert-butyl(dimethyl)silyl]prop-1-en-2-yl]-19-methylicosa-1,18-dien-4,8,14-triyn-3-ol
CID 11374361
(E,3R,4R)-8-[tert-butyl(dimethyl)silyl]oxy-3,5-dimethyl-1-tri(propan-2-yl)silyloct-5-en-1-yn-4-ol
CID 11633537
(E,3R,4S)-3-methyl-1-tri(propan-2-yl)silyldec-5-en-1-yn-4-ol
CID 11674197
(E,3R,4R,7R)-8-[tert-butyl(dimethyl)silyl]oxy-3,5,7-trimethyl-1-tri(propan-2-yl)silyloct-5-en-1-yn-4-ol
CID 11698150
(E,4R)-8-[tert-butyl(dimethyl)silyl]oxy-7,7-dimethyl-1-trimethylsilyloct-5-en-1-yn-4-ol
CID 25146570
triethyl-[(E)-3-methyldodec-2-en-5-yn-4-yl]oxysilane
CID 46895233
(2R,3S,4E,6R,7S,8Z)-3,5,7-trimethyl-2-triethylsilyloxydodeca-4,8-dien-10-yn-6-ol
CID 49836104
(6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-ynal
CID 101649917
(3E)-3-[[tert-butyl(dimethyl)silyl]oxymethyl]nona-3,8-dien-2-ol
CID 102257206

Frequently Asked Questions

What is the IUPAC name of (6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol?
The IUPAC name of (6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol (CID 134875012) is (6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol.
What is the SMILES notation for (6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol?
The canonical SMILES for (6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol is CC(C)=CCC/C(C)=C/CC/C(C)=C/C(CC#CCO)O[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of (6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol?
The InChIKey is IXZONFAPIWOLKR-WZGXYAEVSA-N. The full InChI is InChI=1S/C28H50O2Si/c1-22(2)15-13-16-26(9)17-14-18-27(10)21-28(19-11-12-20-29)30-31(23(3)4,24(5)6)25(7)8/h15,17,21,23-25,28-29H,13-14,16,18-20H2,1-10H3/b26-17+,27-21+.
What are the key properties of (6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol?
(6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol has a molecular weight of 446.79 g/mol, XLogP of 8.35, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,10E)-7,11,15-trimethyl-5-tri(propan-2-yl)silyloxyhexadeca-6,10,14-trien-2-yn-1-ol is sourced from PubChem (CID 134875012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).