dodecan-3-yloxy-dimethyl-prop-2-enylsilane

C17H36OSi — CID 554233

IUPACdodecan-3-yloxy-dimethyl-prop-2-enylsilane
SMILESC=CC[Si](C)(C)OC(CC)CCCCCCCCC
InChIInChI=1S/C17H36OSi/c1-6-9-10-11-12-13-14-15-17(8-3)18-19(4,5)16-7-2/h7,17H,2,6,8-16H2,1,3-5H3
InChIKeyCGBQOMRKUMVHCN-UHFFFAOYSA-N
MW284.56 g/mol
LogP6.31
Rot. Bonds13

About dodecan-3-yloxy-dimethyl-prop-2-enylsilane

dodecan-3-yloxy-dimethyl-prop-2-enylsilane (PubChem CID 554233) has the molecular formula C17H36OSi and a molecular weight of 284.56 g/mol. Its IUPAC name is dodecan-3-yloxy-dimethyl-prop-2-enylsilane.

Molecular Properties

Compound Namedodecan-3-yloxy-dimethyl-prop-2-enylsilane
PubChem CID554233
Molecular FormulaC17H36OSi
Molecular Weight284.56 g/mol
Exact Mass284.25
IUPAC Namedodecan-3-yloxy-dimethyl-prop-2-enylsilane
SMILESC=CC[Si](C)(C)OC(CC)CCCCCCCCC
InChIInChI=1S/C17H36OSi/c1-6-9-10-11-12-13-14-15-17(8-3)18-19(4,5)16-7-2/h7,17H,2,6,8-16H2,1,3-5H3
InChIKeyCGBQOMRKUMVHCN-UHFFFAOYSA-N
XLogP6.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.56
LogP ≤ 56.31
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 dodecan-3-yloxy-dimethyl-prop-2-enylsilane?
The IUPAC name of dodecan-3-yloxy-dimethyl-prop-2-enylsilane (CID 554233) is dodecan-3-yloxy-dimethyl-prop-2-enylsilane.
What is the SMILES notation for dodecan-3-yloxy-dimethyl-prop-2-enylsilane?
The canonical SMILES for dodecan-3-yloxy-dimethyl-prop-2-enylsilane is C=CC[Si](C)(C)OC(CC)CCCCCCCCC.
What is the InChIKey of dodecan-3-yloxy-dimethyl-prop-2-enylsilane?
The InChIKey is CGBQOMRKUMVHCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36OSi/c1-6-9-10-11-12-13-14-15-17(8-3)18-19(4,5)16-7-2/h7,17H,2,6,8-16H2,1,3-5H3.
What are the key properties of dodecan-3-yloxy-dimethyl-prop-2-enylsilane?
dodecan-3-yloxy-dimethyl-prop-2-enylsilane has a molecular weight of 284.56 g/mol, XLogP of 6.31, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dodecan-3-yloxy-dimethyl-prop-2-enylsilane is sourced from PubChem (CID 554233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).