dimethyl-prop-2-enyl-tridecan-6-yloxysilane

C18H38OSi — CID 554237

IUPACdimethyl-prop-2-enyl-tridecan-6-yloxysilane
SMILESC=CC[Si](C)(C)OC(CCCCC)CCCCCCC
InChIInChI=1S/C18H38OSi/c1-6-9-11-12-14-16-18(15-13-10-7-2)19-20(4,5)17-8-3/h8,18H,3,6-7,9-17H2,1-2,4-5H3
InChIKeyCGANXWHFAOKJEL-UHFFFAOYSA-N
MW298.59 g/mol
LogP6.70
Rot. Bonds14

About dimethyl-prop-2-enyl-tridecan-6-yloxysilane

dimethyl-prop-2-enyl-tridecan-6-yloxysilane (PubChem CID 554237) has the molecular formula C18H38OSi and a molecular weight of 298.59 g/mol. Its IUPAC name is dimethyl-prop-2-enyl-tridecan-6-yloxysilane.

Molecular Properties

Compound Namedimethyl-prop-2-enyl-tridecan-6-yloxysilane
PubChem CID554237
Molecular FormulaC18H38OSi
Molecular Weight298.59 g/mol
Exact Mass298.27
IUPAC Namedimethyl-prop-2-enyl-tridecan-6-yloxysilane
SMILESC=CC[Si](C)(C)OC(CCCCC)CCCCCCC
InChIInChI=1S/C18H38OSi/c1-6-9-11-12-14-16-18(15-13-10-7-2)19-20(4,5)17-8-3/h8,18H,3,6-7,9-17H2,1-2,4-5H3
InChIKeyCGANXWHFAOKJEL-UHFFFAOYSA-N
XLogP6.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.59
LogP ≤ 56.70
H-Bond Donors ≤ 50
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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Related Compounds

Tert-butyl(dec-9-enyloxy)dimethylsilane
CID 10869380
1-Nonen-3-ol, tert-butyldimethylsilyl ether
CID 10868924
1-Triethylsilyloxyundec-10-ene
CID 568575
Silane, methylvinyl(octyloxy)octyloxy-
CID 23105081
Silane, methylvinyl(dodecyloxy)dodecyloxy-
CID 87770809
Silane, (1,1-dimethylethyl)dimethyl(10-undecenyloxy)-
CID 10265922
11-(Dimethyldodecylsilyloxy)undec-1-ene
CID 531763
Silane, methylvinyl(oct-2-yloxy)ethoxy-
CID 91723234
Silane, methylvinyl(oct-2-yloxy)propoxy-
CID 91726228
Silane, methylvinyl(octyloxy)(methylvinylisopropoxysilyloxy)-
CID 91726728
Silane, methylvinyl(nonyloxy)(methylvinylisopropoxysilyloxy)-
CID 91726729
Silane, methylvinyl(oct-2-yloxy)butoxy-
CID 91730071

Frequently Asked Questions

What is the IUPAC name of dimethyl-prop-2-enyl-tridecan-6-yloxysilane?
The IUPAC name of dimethyl-prop-2-enyl-tridecan-6-yloxysilane (CID 554237) is dimethyl-prop-2-enyl-tridecan-6-yloxysilane.
What is the SMILES notation for dimethyl-prop-2-enyl-tridecan-6-yloxysilane?
The canonical SMILES for dimethyl-prop-2-enyl-tridecan-6-yloxysilane is C=CC[Si](C)(C)OC(CCCCC)CCCCCCC.
What is the InChIKey of dimethyl-prop-2-enyl-tridecan-6-yloxysilane?
The InChIKey is CGANXWHFAOKJEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38OSi/c1-6-9-11-12-14-16-18(15-13-10-7-2)19-20(4,5)17-8-3/h8,18H,3,6-7,9-17H2,1-2,4-5H3.
What are the key properties of dimethyl-prop-2-enyl-tridecan-6-yloxysilane?
dimethyl-prop-2-enyl-tridecan-6-yloxysilane has a molecular weight of 298.59 g/mol, XLogP of 6.70, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-prop-2-enyl-tridecan-6-yloxysilane is sourced from PubChem (CID 554237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).