trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane

C19H38O2Si — CID 24851251

IUPACtrimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane
SMILESC=CCC/C=C/[C@@H](CCCCCC)OCOCC[Si](C)(C)C
InChIInChI=1S/C19H38O2Si/c1-6-8-10-12-14-19(15-13-11-9-7-2)21-18-20-16-17-22(3,4)5/h6,12,14,19H,1,7-11,13,15-18H2,2-5H3/b14-12+/t19-/m0/s1
InChIKeyKMWCNJJRRVIORL-XUDAUXSOSA-N
MW326.60 g/mol
LogP6.18
Rot. Bonds15

About trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane

trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane (PubChem CID 24851251) has the molecular formula C19H38O2Si and a molecular weight of 326.60 g/mol. Its IUPAC name is trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane
PubChem CID24851251
Molecular FormulaC19H38O2Si
Molecular Weight326.60 g/mol
Exact Mass326.26
IUPAC Nametrimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane
SMILESC=CCC/C=C/[C@@H](CCCCCC)OCOCC[Si](C)(C)C
InChIInChI=1S/C19H38O2Si/c1-6-8-10-12-14-19(15-13-11-9-7-2)21-18-20-16-17-22(3,4)5/h6,12,14,19H,1,7-11,13,15-18H2,2-5H3/b14-12+/t19-/m0/s1
InChIKeyKMWCNJJRRVIORL-XUDAUXSOSA-N
XLogP6.18
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.60
LogP ≤ 56.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane?
The IUPAC name of trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane (CID 24851251) is trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane.
What is the SMILES notation for trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane?
The canonical SMILES for trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane is C=CCC/C=C/[C@@H](CCCCCC)OCOCC[Si](C)(C)C.
What is the InChIKey of trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane?
The InChIKey is KMWCNJJRRVIORL-XUDAUXSOSA-N. The full InChI is InChI=1S/C19H38O2Si/c1-6-8-10-12-14-19(15-13-11-9-7-2)21-18-20-16-17-22(3,4)5/h6,12,14,19H,1,7-11,13,15-18H2,2-5H3/b14-12+/t19-/m0/s1.
What are the key properties of trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane?
trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane has a molecular weight of 326.60 g/mol, XLogP of 6.18, 15 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[[(5E,7R)-trideca-1,5-dien-7-yl]oxymethoxy]ethyl]silane is sourced from PubChem (CID 24851251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).