[5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane

C15H32O2Si — CID 139634859

IUPAC[5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane
SMILESCOCC(CC=CC[Si](C)(C)C)(COC)C(C)C
InChIInChI=1S/C15H32O2Si/c1-14(2)15(12-16-3,13-17-4)10-8-9-11-18(5,6)7/h8-9,14H,10-13H2,1-7H3
InChIKeyPNEKVEIBAXGUTK-UHFFFAOYSA-N
MW272.50 g/mol
LogP4.21
Rot. Bonds9

About [5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane

[5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane (PubChem CID 139634859) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is [5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane.

Molecular Properties

Compound Name[5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane
PubChem CID139634859
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Name[5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane
SMILESCOCC(CC=CC[Si](C)(C)C)(COC)C(C)C
InChIInChI=1S/C15H32O2Si/c1-14(2)15(12-16-3,13-17-4)10-8-9-11-18(5,6)7/h8-9,14H,10-13H2,1-7H3
InChIKeyPNEKVEIBAXGUTK-UHFFFAOYSA-N
XLogP4.21
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.50
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5,5-Bis(methoxymethyl)-4,6-dimethylhept-2-ene
CID 85756856
[(E)-5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane
CID 88082698
tert-butyl-methoxy-dimethylsilane;3-methoxy-2,2-dimethylpentane;(E)-7,8,8-trimethylnon-3-ene
CID 158118941
Tert-butyl-(2-tert-butylpent-4-enoxy)-dimethylsilane
CID 10658771
tert-butyl-[(Z)-2-tert-butylhex-4-enoxy]-dimethylsilane
CID 10707204
[(Z,4R)-4-[(1S)-1-methoxyethyl]-5,5-dimethylhex-2-en-3-yl]-trimethylsilane
CID 102355971

Frequently Asked Questions

What is the IUPAC name of [5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane?
The IUPAC name of [5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane (CID 139634859) is [5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane.
What is the SMILES notation for [5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane?
The canonical SMILES for [5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane is COCC(CC=CC[Si](C)(C)C)(COC)C(C)C.
What is the InChIKey of [5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane?
The InChIKey is PNEKVEIBAXGUTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-14(2)15(12-16-3,13-17-4)10-8-9-11-18(5,6)7/h8-9,14H,10-13H2,1-7H3.
What are the key properties of [5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane?
[5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane has a molecular weight of 272.50 g/mol, XLogP of 4.21, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5,5-bis(methoxymethyl)-6-methylhept-2-enyl]-trimethylsilane is sourced from PubChem (CID 139634859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).