dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane

C20H39F3Si — CID 19770317

IUPACdimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane
SMILESC=CCCCCCCCCCCCCC[Si](C)(C)CC(F)C(F)F
InChIInChI=1S/C20H39F3Si/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(2,3)18-19(21)20(22)23/h4,19-20H,1,5-18H2,2-3H3
InChIKeyVKJSWPYXIYSSHF-UHFFFAOYSA-N
MW364.61 g/mol
LogP8.17
Rot. Bonds17

About dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane

dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane (PubChem CID 19770317) has the molecular formula C20H39F3Si and a molecular weight of 364.61 g/mol. Its IUPAC name is dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane.

Molecular Properties

Compound Namedimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane
PubChem CID19770317
Molecular FormulaC20H39F3Si
Molecular Weight364.61 g/mol
Exact Mass364.28
IUPAC Namedimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane
SMILESC=CCCCCCCCCCCCCC[Si](C)(C)CC(F)C(F)F
InChIInChI=1S/C20H39F3Si/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(2,3)18-19(21)20(22)23/h4,19-20H,1,5-18H2,2-3H3
InChIKeyVKJSWPYXIYSSHF-UHFFFAOYSA-N
XLogP8.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds17
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.61
LogP ≤ 58.17
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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Frequently Asked Questions

What is the IUPAC name of dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane?
The IUPAC name of dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane (CID 19770317) is dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane.
What is the SMILES notation for dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane?
The canonical SMILES for dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane is C=CCCCCCCCCCCCCC[Si](C)(C)CC(F)C(F)F.
What is the InChIKey of dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane?
The InChIKey is VKJSWPYXIYSSHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H39F3Si/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(2,3)18-19(21)20(22)23/h4,19-20H,1,5-18H2,2-3H3.
What are the key properties of dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane?
dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane has a molecular weight of 364.61 g/mol, XLogP of 8.17, 17 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-pentadec-14-enyl-(2,3,3-trifluoropropyl)silane is sourced from PubChem (CID 19770317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).