(6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane

C20H33FOSi — CID 122226622

IUPAC(6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](OC1c2cc(F)ccc2CC1(C)C)(C(C)C)C(C)C
InChIInChI=1S/C20H33FOSi/c1-13(2)23(14(3)4,15(5)6)22-19-18-11-17(21)10-9-16(18)12-20(19,7)8/h9-11,13-15,19H,12H2,1-8H3
InChIKeyAJVCKLPZSSVHDM-UHFFFAOYSA-N
MW336.57 g/mol
LogP6.64
Rot. Bonds5

About (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane

(6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane (PubChem CID 122226622) has the molecular formula C20H33FOSi and a molecular weight of 336.57 g/mol. Its IUPAC name is (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name(6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane
PubChem CID122226622
Molecular FormulaC20H33FOSi
Molecular Weight336.57 g/mol
Exact Mass336.23
IUPAC Name(6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](OC1c2cc(F)ccc2CC1(C)C)(C(C)C)C(C)C
InChIInChI=1S/C20H33FOSi/c1-13(2)23(14(3)4,15(5)6)22-19-18-11-17(21)10-9-16(18)12-20(19,7)8/h9-11,13-15,19H,12H2,1-8H3
InChIKeyAJVCKLPZSSVHDM-UHFFFAOYSA-N
XLogP6.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.57
LogP ≤ 56.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Trimethyl-[9-(trifluoromethyl)fluoren-9-yl]oxysilane
CID 11472732
[(1S,9R,10R)-5-fluoro-9-tetracyclo[9.2.1.02,10.03,8]tetradeca-3(8),4,6-trienyl]oxy-tri(propan-2-yl)silane
CID 134959747
tert-butyl-dimethyl-[[(1S,2S)-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1H-inden-1-yl]oxy]silane
CID 162537325
Triethyl-[[2-fluoro-9-(triethylsilyloxymethyl)fluoren-9-yl]methoxy]silane
CID 22639117
[9-[[Dimethyl(propyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy-dimethyl-propylsilane
CID 22639120
Ethyl-[[9-[[ethyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane
CID 22639121
Tert-butyl-[[9-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane
CID 22639132
Tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane
CID 22975271
2-[(5,6-difluoro-2,3-dihydro-1H-inden-1-yl)oxy]ethyl-trimethylsilane
CID 58950894
2-[(S)-1-(tert-butyl-dimethyl-silanyloxy)-indan-4-yl]-2,2-difluoro-ethanol
CID 67812842
tert-butyl-[[(1S)-4-(1,1-difluoro-2-methoxy-2-methylpropyl)-2,3-dihydro-1H-inden-1-yl]oxy]-dimethylsilane
CID 67813661
1-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-2,3-dihydro-1H-inden-4-yl]-1,1-difluoro-2-methylpropan-2-ol
CID 67814341

Frequently Asked Questions

What is the IUPAC name of (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane?
The IUPAC name of (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane (CID 122226622) is (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane.
What is the SMILES notation for (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane?
The canonical SMILES for (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane is CC(C)[Si](OC1c2cc(F)ccc2CC1(C)C)(C(C)C)C(C)C.
What is the InChIKey of (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane?
The InChIKey is AJVCKLPZSSVHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H33FOSi/c1-13(2)23(14(3)4,15(5)6)22-19-18-11-17(21)10-9-16(18)12-20(19,7)8/h9-11,13-15,19H,12H2,1-8H3.
What are the key properties of (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane?
(6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane has a molecular weight of 336.57 g/mol, XLogP of 6.64, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoro-2,2-dimethyl-1,3-dihydroinden-1-yl)oxy-tri(propan-2-yl)silane is sourced from PubChem (CID 122226622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).