[(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol

C15H24OSi — CID 101172105

IUPAC[(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol
SMILESC[C@@H]1[C@H](C)C1(C(O)c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C15H24OSi/c1-11-12(2)15(11,17(3,4)5)14(16)13-9-7-6-8-10-13/h6-12,14,16H,1-5H3/t11-,12+,14?,15?
InChIKeyKGBLSRSSSCVZTK-AVJIGQEQSA-N
MW248.44 g/mol
LogP4.08
Rot. Bonds3

About [(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol

[(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol (PubChem CID 101172105) has the molecular formula C15H24OSi and a molecular weight of 248.44 g/mol. Its IUPAC name is [(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol.

Molecular Properties

Compound Name[(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol
PubChem CID101172105
Molecular FormulaC15H24OSi
Molecular Weight248.44 g/mol
Exact Mass248.16
IUPAC Name[(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol
SMILESC[C@@H]1[C@H](C)C1(C(O)c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C15H24OSi/c1-11-12(2)15(11,17(3,4)5)14(16)13-9-7-6-8-10-13/h6-12,14,16H,1-5H3/t11-,12+,14?,15?
InChIKeyKGBLSRSSSCVZTK-AVJIGQEQSA-N
XLogP4.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.44
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(R)-[(2S,3S)-3-methyl-2-phenyloxiran-2-yl]-phenylmethanol
CID 134930519
(R)-[(2S,3R)-3-methyl-2-phenyloxiran-2-yl]-phenylmethanol
CID 134931163
(R)-[(1S)-2,2-diphenyl-1-trimethylsilylcyclopropyl]-phenylmethanol
CID 99771519
[[hydroxy(phenyl)methyl]-dimethylsilyl]-phenylmethanol
CID 150347911
phenyl-[(2R)-2-(trifluoromethyl)oxiran-2-yl]methanol
CID 12037703
phenyl-(3-phenyloxaziridin-3-yl)methanol
CID 88777993
(1S)-1-phenylethanol
CID 157125626
(R)-phenyl-(2-phenyl-1,3-dioxolan-2-yl)methanol
CID 41097603
(1S,2R)-2-methyl-1-phenyl-3-trimethylsilylbut-3-en-1-ol
CID 10857402
[diethoxy(methyl)silyl]-phenylmethanol
CID 140892861
1,2-diphenylethane-1,2-diol
CID 159073808
(R)-[tert-butyl(dimethyl)silyl]-phenylmethanol
CID 101051972

Frequently Asked Questions

What is the IUPAC name of [(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol?
The IUPAC name of [(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol (CID 101172105) is [(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol.
What is the SMILES notation for [(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol?
The canonical SMILES for [(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol is C[C@@H]1[C@H](C)C1(C(O)c1ccccc1)[Si](C)(C)C.
What is the InChIKey of [(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol?
The InChIKey is KGBLSRSSSCVZTK-AVJIGQEQSA-N. The full InChI is InChI=1S/C15H24OSi/c1-11-12(2)15(11,17(3,4)5)14(16)13-9-7-6-8-10-13/h6-12,14,16H,1-5H3/t11-,12+,14?,15?.
What are the key properties of [(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol?
[(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol has a molecular weight of 248.44 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3S)-2,3-dimethyl-1-trimethylsilylcyclopropyl]-phenylmethanol is sourced from PubChem (CID 101172105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).