dimethyl-prop-2-enyl-tridecan-7-yloxysilane

C18H38OSi — CID 554238

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

About dimethyl-prop-2-enyl-tridecan-7-yloxysilane

dimethyl-prop-2-enyl-tridecan-7-yloxysilane (PubChem CID 554238) has the molecular formula C18H38OSi and a molecular weight of 298.59 g/mol. Its IUPAC name is dimethyl-prop-2-enyl-tridecan-7-yloxysilane.

Molecular Properties

Compound Namedimethyl-prop-2-enyl-tridecan-7-yloxysilane
PubChem CID554238
Molecular FormulaC18H38OSi
Molecular Weight298.59 g/mol
Exact Mass298.27
IUPAC Namedimethyl-prop-2-enyl-tridecan-7-yloxysilane
SMILESC=CC[Si](C)(C)OC(CCCCCC)CCCCCC
InChIInChI=1S/C18H38OSi/c1-6-9-11-13-15-18(16-14-12-10-7-2)19-20(4,5)17-8-3/h8,18H,3,6-7,9-17H2,1-2,4-5H3
InChIKeyCKIGUJBXWRUOAJ-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-7-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-7-yloxysilane?
The IUPAC name of dimethyl-prop-2-enyl-tridecan-7-yloxysilane (CID 554238) is dimethyl-prop-2-enyl-tridecan-7-yloxysilane.
What is the SMILES notation for dimethyl-prop-2-enyl-tridecan-7-yloxysilane?
The canonical SMILES for dimethyl-prop-2-enyl-tridecan-7-yloxysilane is C=CC[Si](C)(C)OC(CCCCCC)CCCCCC.
What is the InChIKey of dimethyl-prop-2-enyl-tridecan-7-yloxysilane?
The InChIKey is CKIGUJBXWRUOAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38OSi/c1-6-9-11-13-15-18(16-14-12-10-7-2)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-7-yloxysilane?
dimethyl-prop-2-enyl-tridecan-7-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-7-yloxysilane is sourced from PubChem (CID 554238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).