[(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane

C18H28O2Si — CID 125497693

IUPAC[(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane
SMILESC[Si](C)(C)O[C@](c1ccccc1)(C1CCCCC1)[C@@H]1CO1
InChIInChI=1S/C18H28O2Si/c1-21(2,3)20-18(17-14-19-17,15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4,6-7,10-11,16-17H,5,8-9,12-14H2,1-3H3/t17-,18+/m0/s1
InChIKeyKLOOPMXTEQGZFQ-ZWKOTPCHSA-N
MW304.51 g/mol
LogP4.71
Rot. Bonds5

About [(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane

[(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane (PubChem CID 125497693) has the molecular formula C18H28O2Si and a molecular weight of 304.51 g/mol. Its IUPAC name is [(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane.

Molecular Properties

Compound Name[(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane
PubChem CID125497693
Molecular FormulaC18H28O2Si
Molecular Weight304.51 g/mol
Exact Mass304.19
IUPAC Name[(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane
SMILESC[Si](C)(C)O[C@](c1ccccc1)(C1CCCCC1)[C@@H]1CO1
InChIInChI=1S/C18H28O2Si/c1-21(2,3)20-18(17-14-19-17,15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4,6-7,10-11,16-17H,5,8-9,12-14H2,1-3H3/t17-,18+/m0/s1
InChIKeyKLOOPMXTEQGZFQ-ZWKOTPCHSA-N
XLogP4.71
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.51
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-cyclohexyl-2-phenyl-2-trimethylsilyloxyethylidene)hydroxylamine
CID 154299369
2-cyclobutyl-2-phenyl-2-trimethylsilyloxyacetonitrile
CID 101208199
1-cyclohexyl-1-phenyl-1-trimethylsilyloxyhex-5-yn-2-one
CID 15105840
[2-cyclohexyl-2-[ethenyl(dimethyl)silyl]-1,1-diphenylpropoxy]-ethenyl-dimethylsilane
CID 58556690
trimethyl(trityloxy)silane
CID 11067560
(2,3-diphenyl-3-trimethylsilyloxybutan-2-yl)oxy-trimethylsilane
CID 10068766
(S)-cyclohexyl-[(4S,5S)-5-[(S)-cyclohexyl-hydroxy-phenylmethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-phenylmethanol
CID 101412837
(1R)-1-cyclopentyl-1-phenylethanol;sulfane
CID 158992083
1-[cyclohexyl-(4-methoxyphenyl)-phenylmethyl]-4-methoxybenzene
CID 71260606
cyclohexyl-phenyl-(1,3-thiazol-2-yl)methanol
CID 162419779
2-cyclohexyl-2-(methylamino)-2-phenylacetaldehyde
CID 174829123
(2-cyclopentyl-1,3-dimethoxypropan-2-yl)benzene
CID 150061832

Frequently Asked Questions

What is the IUPAC name of [(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane?
The IUPAC name of [(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane (CID 125497693) is [(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane.
What is the SMILES notation for [(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane?
The canonical SMILES for [(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane is C[Si](C)(C)O[C@](c1ccccc1)(C1CCCCC1)[C@@H]1CO1.
What is the InChIKey of [(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane?
The InChIKey is KLOOPMXTEQGZFQ-ZWKOTPCHSA-N. The full InChI is InChI=1S/C18H28O2Si/c1-21(2,3)20-18(17-14-19-17,15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4,6-7,10-11,16-17H,5,8-9,12-14H2,1-3H3/t17-,18+/m0/s1.
What are the key properties of [(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane?
[(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane has a molecular weight of 304.51 g/mol, XLogP of 4.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(S)-cyclohexyl-[(2S)-oxiran-2-yl]-phenylmethoxy]-trimethylsilane is sourced from PubChem (CID 125497693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).