(5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol

C20H36OSi — CID 135008828

IUPAC(5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol
SMILESC/C=C/C/C=C(/C)C/C(=C/[Si](C)(C)C)C/C=C\CCCCO
InChIInChI=1S/C20H36OSi/c1-6-7-11-14-19(2)17-20(18-22(3,4)5)15-12-9-8-10-13-16-21/h6-7,9,12,14,18,21H,8,10-11,13,15-17H2,1-5H3/b7-6+,12-9-,19-14-,20-18+
InChIKeyDXJGSVYWDKVBKX-KIBVCTIRSA-N
MW320.59 g/mol
LogP6.20
Rot. Bonds11

About (5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol

(5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol (PubChem CID 135008828) has the molecular formula C20H36OSi and a molecular weight of 320.59 g/mol. Its IUPAC name is (5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol.

Molecular Properties

Compound Name(5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol
PubChem CID135008828
Molecular FormulaC20H36OSi
Molecular Weight320.59 g/mol
Exact Mass320.25
IUPAC Name(5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol
SMILESC/C=C/C/C=C(/C)C/C(=C/[Si](C)(C)C)C/C=C\CCCCO
InChIInChI=1S/C20H36OSi/c1-6-7-11-14-19(2)17-20(18-22(3,4)5)15-12-9-8-10-13-16-21/h6-7,9,12,14,18,21H,8,10-11,13,15-17H2,1-5H3/b7-6+,12-9-,19-14-,20-18+
InChIKeyDXJGSVYWDKVBKX-KIBVCTIRSA-N
XLogP6.20
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.59
LogP ≤ 56.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol?
The IUPAC name of (5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol (CID 135008828) is (5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol.
What is the SMILES notation for (5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol?
The canonical SMILES for (5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol is C/C=C/C/C=C(/C)C/C(=C/[Si](C)(C)C)C/C=C\CCCCO.
What is the InChIKey of (5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol?
The InChIKey is DXJGSVYWDKVBKX-KIBVCTIRSA-N. The full InChI is InChI=1S/C20H36OSi/c1-6-7-11-14-19(2)17-20(18-22(3,4)5)15-12-9-8-10-13-16-21/h6-7,9,12,14,18,21H,8,10-11,13,15-17H2,1-5H3/b7-6+,12-9-,19-14-,20-18+.
What are the key properties of (5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol?
(5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol has a molecular weight of 320.59 g/mol, XLogP of 6.20, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol is sourced from PubChem (CID 135008828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).