(2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol

C14H22OSi — CID 102406326

IUPAC(2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol
SMILESC=C[C@@H](C)[C@](C)(O)[Si](C)(C)c1ccccc1
InChIInChI=1S/C14H22OSi/c1-6-12(2)14(3,15)16(4,5)13-10-8-7-9-11-13/h6-12,15H,1H2,2-5H3/t12-,14-/m1/s1
InChIKeyJRASBQDYIZIUMJ-TZMCWYRMSA-N
MW234.41 g/mol
LogP2.71
Rot. Bonds4

About (2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol

(2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol (PubChem CID 102406326) has the molecular formula C14H22OSi and a molecular weight of 234.41 g/mol. Its IUPAC name is (2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol.

Molecular Properties

Compound Name(2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol
PubChem CID102406326
Molecular FormulaC14H22OSi
Molecular Weight234.41 g/mol
Exact Mass234.14
IUPAC Name(2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol
SMILESC=C[C@@H](C)[C@](C)(O)[Si](C)(C)c1ccccc1
InChIInChI=1S/C14H22OSi/c1-6-12(2)14(3,15)16(4,5)13-10-8-7-9-11-13/h6-12,15H,1H2,2-5H3/t12-,14-/m1/s1
InChIKeyJRASBQDYIZIUMJ-TZMCWYRMSA-N
XLogP2.71
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.41
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[(3S)-4,4-dimethylpent-1-en-3-yl]-dimethyl-phenylsilane
CID 71712408
[(2R)-but-3-en-2-yl]-dimethyl-phenylsilane
CID 134947847
dimethyl-phenyl-[(2S)-2-phenylbut-3-en-2-yl]silane
CID 71712694
2-[(2R,3R)-2-hydroxy-3-methylpent-4-en-2-yl]phenol
CID 14939211
(1E,3S,4S)-4-tert-butyl-1-[dimethyl(phenyl)silyl]hexa-1,5-dien-3-ol
CID 102328927
6-[hydroxy(diphenyl)silyl]-6-methylhept-1-ene-3-thiol
CID 89032425
2-hydroxy-3-methyl-2-phenylpent-4-enoic acid
CID 13026557
(2S,3R)-3-[tert-butyl(diphenyl)silyl]oxypent-4-en-2-ol
CID 102030687
(2R,3R)-2-(2-aminophenyl)-3-methylpent-4-en-2-ol
CID 14939216
(2S)-2-[dimethyl(phenyl)silyl]but-3-en-1-ol
CID 134955377
2-[dimethyl(phenyl)silyl]-5,5-dimethylhex-3-yn-2-ol
CID 166442245
2-[(1S,2R)-1-hydroxy-2-methyl-1-phenylbut-3-enyl]phenol
CID 11514371

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol?
The IUPAC name of (2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol (CID 102406326) is (2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol.
What is the SMILES notation for (2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol?
The canonical SMILES for (2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol is C=C[C@@H](C)[C@](C)(O)[Si](C)(C)c1ccccc1.
What is the InChIKey of (2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol?
The InChIKey is JRASBQDYIZIUMJ-TZMCWYRMSA-N. The full InChI is InChI=1S/C14H22OSi/c1-6-12(2)14(3,15)16(4,5)13-10-8-7-9-11-13/h6-12,15H,1H2,2-5H3/t12-,14-/m1/s1.
What are the key properties of (2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol?
(2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol has a molecular weight of 234.41 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2-[dimethyl(phenyl)silyl]-3-methylpent-4-en-2-ol is sourced from PubChem (CID 102406326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).