tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane

C14H30OSi — CID 89408189

IUPACtert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane
SMILESC=C(CC)C[C@H](CC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H30OSi/c1-9-12(3)11-13(10-2)15-16(7,8)14(4,5)6/h13H,3,9-11H2,1-2,4-8H3/t13-/m0/s1
InChIKeyQENIAIWWAOUZTO-ZDUSSCGKSA-N
MW242.48 g/mol
LogP5.14
Rot. Bonds6

About tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane

tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane (PubChem CID 89408189) has the molecular formula C14H30OSi and a molecular weight of 242.48 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane
PubChem CID89408189
Molecular FormulaC14H30OSi
Molecular Weight242.48 g/mol
Exact Mass242.21
IUPAC Nametert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane
SMILESC=C(CC)C[C@H](CC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H30OSi/c1-9-12(3)11-13(10-2)15-16(7,8)14(4,5)6/h13H,3,9-11H2,1-2,4-8H3/t13-/m0/s1
InChIKeyQENIAIWWAOUZTO-ZDUSSCGKSA-N
XLogP5.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500242.48
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane 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 tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane (CID 89408189) is tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane is C=C(CC)C[C@H](CC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane?
The InChIKey is QENIAIWWAOUZTO-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H30OSi/c1-9-12(3)11-13(10-2)15-16(7,8)14(4,5)6/h13H,3,9-11H2,1-2,4-8H3/t13-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane?
tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane has a molecular weight of 242.48 g/mol, XLogP of 5.14, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane is sourced from PubChem (CID 89408189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).