2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol

C22H30O2Si — CID 59912172

IUPAC2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol
SMILESC[Si](C)(C)OCCC1c2ccccc2C(c2ccccc2)C1CCO
InChIInChI=1S/C22H30O2Si/c1-25(2,3)24-16-14-19-18-11-7-8-12-20(18)22(21(19)13-15-23)17-9-5-4-6-10-17/h4-12,19,21-23H,13-16H2,1-3H3
InChIKeyNPEWZTMVLYBHAG-UHFFFAOYSA-N
MW354.57 g/mol
LogP5.16
Rot. Bonds7

About 2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol

2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol (PubChem CID 59912172) has the molecular formula C22H30O2Si and a molecular weight of 354.57 g/mol. Its IUPAC name is 2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol
PubChem CID59912172
Molecular FormulaC22H30O2Si
Molecular Weight354.57 g/mol
Exact Mass354.20
IUPAC Name2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol
SMILESC[Si](C)(C)OCCC1c2ccccc2C(c2ccccc2)C1CCO
InChIInChI=1S/C22H30O2Si/c1-25(2,3)24-16-14-19-18-11-7-8-12-20(18)22(21(19)13-15-23)17-9-5-4-6-10-17/h4-12,19,21-23H,13-16H2,1-3H3
InChIKeyNPEWZTMVLYBHAG-UHFFFAOYSA-N
XLogP5.16
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.57
LogP ≤ 55.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-2,3-diphenyl-2,3-dihydro-1H-indene
CID 57262344
(1S,2S,3S)-1-ethyl-2-methyl-3-phenyl-2,3-dihydro-1H-indene
CID 102284055
ethane;2-(3-phenyloxiran-2-yl)ethanol
CID 143522200
1-[(1S,2S,3S)-2-acetyl-3-phenyl-2,3-dihydro-1H-inden-1-yl]propan-2-one
CID 101461148
1-phenyl-3-trimethylsilyloxypropan-1-ol
CID 100965163
(1S,3S)-1,3-diphenyl-2,3-dihydro-1H-indene-2-carboxylic acid
CID 70130242
2-[(4S,5S)-2,2-dimethyl-5-phenyl-1,3-dioxolan-4-yl]ethanol
CID 118151829
(3S,4R,5S)-5-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-(2-hydroxyethyl)-3-phenylsulfanyloxolan-2-one
CID 25032960
(4S,5S)-4-(2-hydroxyethyl)-5-phenyloxolan-2-one
CID 11424286
4-(2-hydroxyethyl)-4H-phthalazin-1-one
CID 19957086
2-[(2R,3R,4R)-3-(2-methylphenyl)-4-phenyl-5-[(E)-prop-1-enyl]-6-(trifluoromethyl)-3,4-dihydro-2H-pyran-2-yl]ethanol
CID 122233970
2-(2-cyclopenta-1,4-dien-1-yl-1H-inden-1-yl)ethoxy-trimethylsilane;zirconium
CID 87936755

Frequently Asked Questions

What is the IUPAC name of 2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol?
The IUPAC name of 2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol (CID 59912172) is 2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol.
What is the SMILES notation for 2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol?
The canonical SMILES for 2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol is C[Si](C)(C)OCCC1c2ccccc2C(c2ccccc2)C1CCO.
What is the InChIKey of 2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol?
The InChIKey is NPEWZTMVLYBHAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30O2Si/c1-25(2,3)24-16-14-19-18-11-7-8-12-20(18)22(21(19)13-15-23)17-9-5-4-6-10-17/h4-12,19,21-23H,13-16H2,1-3H3.
What are the key properties of 2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol?
2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol has a molecular weight of 354.57 g/mol, XLogP of 5.16, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-phenyl-3-(2-trimethylsilyloxyethyl)-2,3-dihydro-1H-inden-2-yl]ethanol is sourced from PubChem (CID 59912172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).