tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane

C15H30O2Si — CID 11254249

IUPACtert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane
SMILESC=C(CC)C[C@H](C[C@H]1CO1)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H30O2Si/c1-8-12(2)9-13(10-14-11-16-14)17-18(6,7)15(3,4)5/h13-14H,2,8-11H2,1,3-7H3/t13-,14+/m1/s1
InChIKeySWGUZLDXIQVNLB-KGLIPLIRSA-N
MW270.49 g/mol
LogP4.52
Rot. Bonds7

About tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane

tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane (PubChem CID 11254249) has the molecular formula C15H30O2Si and a molecular weight of 270.49 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane
PubChem CID11254249
Molecular FormulaC15H30O2Si
Molecular Weight270.49 g/mol
Exact Mass270.20
IUPAC Nametert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane
SMILESC=C(CC)C[C@H](C[C@H]1CO1)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H30O2Si/c1-8-12(2)9-13(10-14-11-16-14)17-18(6,7)15(3,4)5/h13-14H,2,8-11H2,1,3-7H3/t13-,14+/m1/s1
InChIKeySWGUZLDXIQVNLB-KGLIPLIRSA-N
XLogP4.52
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.49
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-dimethyl-[(2S)-1-[(2S)-oxiran-2-yl]pent-4-en-2-yl]oxysilane
CID 10332001
tert-butyl-dimethyl-[(2R)-1-[(2R)-oxiran-2-yl]pent-4-en-2-yl]oxysilane
CID 10705360
tert-butyl-dimethyl-[(2S)-1-[(2R)-oxiran-2-yl]pent-4-en-2-yl]oxysilane
CID 11564984
tert-butyl-dimethyl-[(2R)-1-[(2S)-oxiran-2-yl]pent-4-en-2-yl]oxysilane
CID 13895986
Tert-butyl-dimethyl-[2-(3-pent-4-enyloxiran-2-yl)prop-2-enoxy]silane
CID 10517052
trimethyl-[(4S)-2-methyldec-1-en-4-yl]oxysilane
CID 16059394
tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane
CID 25111168
tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2R)-oxiran-2-yl]hexan-2-yl]oxysilane
CID 101182103

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane (CID 11254249) is tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane is C=C(CC)C[C@H](C[C@H]1CO1)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane?
The InChIKey is SWGUZLDXIQVNLB-KGLIPLIRSA-N. The full InChI is InChI=1S/C15H30O2Si/c1-8-12(2)9-13(10-14-11-16-14)17-18(6,7)15(3,4)5/h13-14H,2,8-11H2,1,3-7H3/t13-,14+/m1/s1.
What are the key properties of tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane?
tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane has a molecular weight of 270.49 g/mol, XLogP of 4.52, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane is sourced from PubChem (CID 11254249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).