(1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol

C11H22O3Si — CID 11218483

IUPAC(1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol
SMILESC=C([C@@H](O)[C@H]1COC(C)(C)O1)[Si](C)(C)C
InChIInChI=1S/C11H22O3Si/c1-8(15(4,5)6)10(12)9-7-13-11(2,3)14-9/h9-10,12H,1,7H2,2-6H3/t9-,10-/m1/s1
InChIKeyZWJMVMWDQWSNOB-NXEZZACHSA-N
MW230.38 g/mol
LogP1.93
Rot. Bonds3

About (1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol

(1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol (PubChem CID 11218483) has the molecular formula C11H22O3Si and a molecular weight of 230.38 g/mol. Its IUPAC name is (1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol.

Molecular Properties

Compound Name(1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol
PubChem CID11218483
Molecular FormulaC11H22O3Si
Molecular Weight230.38 g/mol
Exact Mass230.13
IUPAC Name(1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol
SMILESC=C([C@@H](O)[C@H]1COC(C)(C)O1)[Si](C)(C)C
InChIInChI=1S/C11H22O3Si/c1-8(15(4,5)6)10(12)9-7-13-11(2,3)14-9/h9-10,12H,1,7H2,2-6H3/t9-,10-/m1/s1
InChIKeyZWJMVMWDQWSNOB-NXEZZACHSA-N
XLogP1.93
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(2-Methyl-1,3-dioxolan-2-yl)-3-trimethylsilylpenta-3,4-dien-2-ol
CID 14295006
1-[(4R)-2,2-diethyl-1,3-dioxolan-4-yl]prop-2-en-1-ol
CID 46193085
(E,1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylbut-2-en-1-ol
CID 11021143
(1R)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol
CID 13539172
(1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-methyl-2-trimethylsilylbut-2-en-1-ol
CID 21729074
(1R)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-methyl-2-trimethylsilylbut-2-en-1-ol
CID 21729130
1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]prop-2-en-1-ol;methane
CID 160428505
1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]prop-2-en-1-ol;methane
CID 160428506
1-(2,2-Dimethyl-1,3-dioxolan-4-yl)prop-2-en-1-ol;ethane
CID 178013766
(1R)-1-[(4S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]prop-2-en-1-ol
CID 10590508
(1R)-1-[(4S,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]prop-2-en-1-ol
CID 10590509
(1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-trimethylsilylbut-3-en-1-ol
CID 10681766

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol?
The IUPAC name of (1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol (CID 11218483) is (1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol.
What is the SMILES notation for (1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol?
The canonical SMILES for (1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol is C=C([C@@H](O)[C@H]1COC(C)(C)O1)[Si](C)(C)C.
What is the InChIKey of (1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol?
The InChIKey is ZWJMVMWDQWSNOB-NXEZZACHSA-N. The full InChI is InChI=1S/C11H22O3Si/c1-8(15(4,5)6)10(12)9-7-13-11(2,3)14-9/h9-10,12H,1,7H2,2-6H3/t9-,10-/m1/s1.
What are the key properties of (1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol?
(1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol has a molecular weight of 230.38 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trimethylsilylprop-2-en-1-ol is sourced from PubChem (CID 11218483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).