(2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol

C16H30O2Si — CID 70837293

IUPAC(2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol
SMILESCC(C)(C)[Si](C)(C)O[C@@H]1C/C(=C\CO)CCC12CC2
InChIInChI=1S/C16H30O2Si/c1-15(2,3)19(4,5)18-14-12-13(7-11-17)6-8-16(14)9-10-16/h7,14,17H,6,8-12H2,1-5H3/b13-7-/t14-/m1/s1
InChIKeyODARUWBWEAPWIB-SVSAJMPUSA-N
MW282.50 g/mol
LogP4.26
Rot. Bonds3

About (2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol

(2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol (PubChem CID 70837293) has the molecular formula C16H30O2Si and a molecular weight of 282.50 g/mol. Its IUPAC name is (2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol.

Molecular Properties

Compound Name(2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol
PubChem CID70837293
Molecular FormulaC16H30O2Si
Molecular Weight282.50 g/mol
Exact Mass282.20
IUPAC Name(2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol
SMILESCC(C)(C)[Si](C)(C)O[C@@H]1C/C(=C\CO)CCC12CC2
InChIInChI=1S/C16H30O2Si/c1-15(2,3)19(4,5)18-14-12-13(7-11-17)6-8-16(14)9-10-16/h7,14,17H,6,8-12H2,1-5H3/b13-7-/t14-/m1/s1
InChIKeyODARUWBWEAPWIB-SVSAJMPUSA-N
XLogP4.26
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.50
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol?
The IUPAC name of (2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol (CID 70837293) is (2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol.
What is the SMILES notation for (2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol?
The canonical SMILES for (2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol is CC(C)(C)[Si](C)(C)O[C@@H]1C/C(=C\CO)CCC12CC2.
What is the InChIKey of (2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol?
The InChIKey is ODARUWBWEAPWIB-SVSAJMPUSA-N. The full InChI is InChI=1S/C16H30O2Si/c1-15(2,3)19(4,5)18-14-12-13(7-11-17)6-8-16(14)9-10-16/h7,14,17H,6,8-12H2,1-5H3/b13-7-/t14-/m1/s1.
What are the key properties of (2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol?
(2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol has a molecular weight of 282.50 g/mol, XLogP of 4.26, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-[(8R)-8-[tert-butyl(dimethyl)silyl]oxyspiro[2.5]octan-6-ylidene]ethanol is sourced from PubChem (CID 70837293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).