dimethyl-prop-2-enyl-tridecan-3-yloxysilane

C18H38OSi — CID 554236

IUPACdimethyl-prop-2-enyl-tridecan-3-yloxysilane
SMILESC=CC[Si](C)(C)OC(CC)CCCCCCCCCC
InChIInChI=1S/C18H38OSi/c1-6-9-10-11-12-13-14-15-16-18(8-3)19-20(4,5)17-7-2/h7,18H,2,6,8-17H2,1,3-5H3
InChIKeyUQXMPLXRMMVVLV-UHFFFAOYSA-N
MW298.59 g/mol
LogP6.70
Rot. Bonds14

About dimethyl-prop-2-enyl-tridecan-3-yloxysilane

dimethyl-prop-2-enyl-tridecan-3-yloxysilane (PubChem CID 554236) has the molecular formula C18H38OSi and a molecular weight of 298.59 g/mol. Its IUPAC name is dimethyl-prop-2-enyl-tridecan-3-yloxysilane.

Molecular Properties

Compound Namedimethyl-prop-2-enyl-tridecan-3-yloxysilane
PubChem CID554236
Molecular FormulaC18H38OSi
Molecular Weight298.59 g/mol
Exact Mass298.27
IUPAC Namedimethyl-prop-2-enyl-tridecan-3-yloxysilane
SMILESC=CC[Si](C)(C)OC(CC)CCCCCCCCCC
InChIInChI=1S/C18H38OSi/c1-6-9-10-11-12-13-14-15-16-18(8-3)19-20(4,5)17-7-2/h7,18H,2,6,8-17H2,1,3-5H3
InChIKeyUQXMPLXRMMVVLV-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'}

Analyze dimethyl-prop-2-enyl-tridecan-3-yloxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of dimethyl-prop-2-enyl-tridecan-3-yloxysilane?
The IUPAC name of dimethyl-prop-2-enyl-tridecan-3-yloxysilane (CID 554236) is dimethyl-prop-2-enyl-tridecan-3-yloxysilane.
What is the SMILES notation for dimethyl-prop-2-enyl-tridecan-3-yloxysilane?
The canonical SMILES for dimethyl-prop-2-enyl-tridecan-3-yloxysilane is C=CC[Si](C)(C)OC(CC)CCCCCCCCCC.
What is the InChIKey of dimethyl-prop-2-enyl-tridecan-3-yloxysilane?
The InChIKey is UQXMPLXRMMVVLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38OSi/c1-6-9-10-11-12-13-14-15-16-18(8-3)19-20(4,5)17-7-2/h7,18H,2,6,8-17H2,1,3-5H3.
What are the key properties of dimethyl-prop-2-enyl-tridecan-3-yloxysilane?
dimethyl-prop-2-enyl-tridecan-3-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-3-yloxysilane is sourced from PubChem (CID 554236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).