triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane

C21H42Si — CID 45140052

IUPACtriethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane
SMILESCC/C=C\CCCCCCCCC/C=C\[Si](CC)(CC)CC
InChIInChI=1S/C21H42Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22(6-2,7-3)8-4/h9-10,20-21H,5-8,11-19H2,1-4H3/b10-9-,21-20-
InChIKeyNBXXPNPYGUVQMX-SUUOITAFSA-N
MW322.65 g/mol
LogP8.07
Rot. Bonds15

About triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane

triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane (PubChem CID 45140052) has the molecular formula C21H42Si and a molecular weight of 322.65 g/mol. Its IUPAC name is triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane.

Molecular Properties

Compound Nametriethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane
PubChem CID45140052
Molecular FormulaC21H42Si
Molecular Weight322.65 g/mol
Exact Mass322.31
IUPAC Nametriethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane
SMILESCC/C=C\CCCCCCCCC/C=C\[Si](CC)(CC)CC
InChIInChI=1S/C21H42Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22(6-2,7-3)8-4/h9-10,20-21H,5-8,11-19H2,1-4H3/b10-9-,21-20-
InChIKeyNBXXPNPYGUVQMX-SUUOITAFSA-N
XLogP8.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds15
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.65
LogP ≤ 58.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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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Related Compounds

(Z)-9-Tricosene
CID 5365075
Octadec-9-ene
CID 5364599
9-Tricosene
CID 6385060
(Z)-8-heptadecene
CID 5352243
(9Z)-9-Octadecene
CID 5352245
8-Heptadecene
CID 5364555
7-Hexadecene, (7Z)-
CID 5364564
1,8-Heptadecadiene
CID 5352844
8-Hexadecene, (8E)-
CID 5352969
(8Z)-8-Hexadecene
CID 5352971
7-Hexadecene
CID 5352264
2-nonadecene (Z)
CID 5352532

Frequently Asked Questions

What is the IUPAC name of triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane?
The IUPAC name of triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane (CID 45140052) is triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane.
What is the SMILES notation for triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane?
The canonical SMILES for triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane is CC/C=C\CCCCCCCCC/C=C\[Si](CC)(CC)CC.
What is the InChIKey of triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane?
The InChIKey is NBXXPNPYGUVQMX-SUUOITAFSA-N. The full InChI is InChI=1S/C21H42Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22(6-2,7-3)8-4/h9-10,20-21H,5-8,11-19H2,1-4H3/b10-9-,21-20-.
What are the key properties of triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane?
triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane has a molecular weight of 322.65 g/mol, XLogP of 8.07, 15 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(1Z,12Z)-pentadeca-1,12-dienyl]silane is sourced from PubChem (CID 45140052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).