tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane

C18H34OSi — CID 140692764

IUPACtert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane
SMILESCC1=CC2CC(C)C(O[Si](C)(C)C(C)(C)C)C(C)C2C1
InChIInChI=1S/C18H34OSi/c1-12-9-15-11-13(2)17(14(3)16(15)10-12)19-20(7,8)18(4,5)6/h9,13-17H,10-11H2,1-8H3
InChIKeyDFIKAKFPQAUUHU-UHFFFAOYSA-N
MW294.56 g/mol
LogP5.64
Rot. Bonds2

About tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane

tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane (PubChem CID 140692764) has the molecular formula C18H34OSi and a molecular weight of 294.56 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane
PubChem CID140692764
Molecular FormulaC18H34OSi
Molecular Weight294.56 g/mol
Exact Mass294.24
IUPAC Nametert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane
SMILESCC1=CC2CC(C)C(O[Si](C)(C)C(C)(C)C)C(C)C2C1
InChIInChI=1S/C18H34OSi/c1-12-9-15-11-13(2)17(14(3)16(15)10-12)19-20(7,8)18(4,5)6/h9,13-17H,10-11H2,1-8H3
InChIKeyDFIKAKFPQAUUHU-UHFFFAOYSA-N
XLogP5.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.56
LogP ≤ 55.64
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-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane with MolForge

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

Launch Full Analysis

Related Compounds

tert-butyl-[[(1S,2S,4S,5S)-4-[2-[(1R)-1,3-dimethylcyclopent-2-en-1-yl]ethyl]-4,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]oxy]-dimethylsilane
CID 11749629
tert-butyl-[[(1S,2S,4S,5S)-4-[(3S)-3,7-dimethyloct-6-enyl]-4,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]oxy]-dimethylsilane
CID 134865393
[(3aS,5R,7aS)-7a-methyl-5-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-inden-3a-yl]methoxy-tri(propan-2-yl)silane
CID 134945478
[(5S,6R,9S,10R)-3,6-dimethyl-9-propan-2-ylspiro[4.5]dec-3-en-10-yl]oxy-triethylsilane
CID 135019405
tert-butyl-[(1S,2Z,3R,6S)-2-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-methyl-6-propan-2-ylcyclohexyl]oxy-dimethylsilane
CID 135025444
(4S,7R)-1-[tert-butyl(dimethyl)silyl]oxy-3,7-dimethyl-4-propan-2-yl-1,4,5,6,7,7a-hexahydroinden-3a-ol
CID 138968869
tri(propan-2-yl)-[(1'S,2'S,5'R,6'R)-spiro[cyclopropane-1,11'-tricyclo[4.3.1.12,5]undec-3-ene]-10'-yl]oxysilane
CID 146019012
tert-butyl-[[(3S,8R,9S,10S,13R,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-dimethylsilane
CID 90662652
tert-butyl-[[(3S,8R,10S,13R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-dimethylsilane
CID 6711345
Silane, trimethyl[[(3beta,4alpha,5alpha)-4-methylcholest-7-en-3-yl]oxy]-
CID 91745675
(3R)-3-[(3aR,4S,7aS)-7a-methyl-4-triethylsilyloxy-3,3a,4,5,6,7-hexahydroinden-1-yl]butan-1-ol
CID 10521012
[(3aR,4S,7aS)-1-[(2R)-4-iodobutan-2-yl]-7a-methyl-3,3a,4,5,6,7-hexahydroinden-4-yl]oxy-triethylsilane
CID 10765875

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane (CID 140692764) is tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane is CC1=CC2CC(C)C(O[Si](C)(C)C(C)(C)C)C(C)C2C1.
What is the InChIKey of tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane?
The InChIKey is DFIKAKFPQAUUHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34OSi/c1-12-9-15-11-13(2)17(14(3)16(15)10-12)19-20(7,8)18(4,5)6/h9,13-17H,10-11H2,1-8H3.
What are the key properties of tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane?
tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane has a molecular weight of 294.56 g/mol, XLogP of 5.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(2,4,6-trimethyl-3a,4,5,6,7,7a-hexahydro-3H-inden-5-yl)oxy]silane is sourced from PubChem (CID 140692764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).