(2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid

C14H24O3Si2 — CID 54395913

IUPAC(2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid
SMILESC[Si](C)(C)O[C@@](C(=O)O)(c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C14H24O3Si2/c1-18(2,3)14(13(15)16,17-19(4,5)6)12-10-8-7-9-11-12/h7-11H,1-6H3,(H,15,16)/t14-/m0/s1
InChIKeyVJXWVNMCVXXROJ-AWEZNQCLSA-N
MW296.51 g/mol
LogP3.70
Rot. Bonds5

About (2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid

(2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid (PubChem CID 54395913) has the molecular formula C14H24O3Si2 and a molecular weight of 296.51 g/mol. Its IUPAC name is (2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid.

Molecular Properties

Compound Name(2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid
PubChem CID54395913
Molecular FormulaC14H24O3Si2
Molecular Weight296.51 g/mol
Exact Mass296.13
IUPAC Name(2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid
SMILESC[Si](C)(C)O[C@@](C(=O)O)(c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C14H24O3Si2/c1-18(2,3)14(13(15)16,17-19(4,5)6)12-10-8-7-9-11-12/h7-11H,1-6H3,(H,15,16)/t14-/m0/s1
InChIKeyVJXWVNMCVXXROJ-AWEZNQCLSA-N
XLogP3.70
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.51
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

dimethyl 2,3-diphenyl-2,3-bis(trimethylsilyloxy)butanedioate
CID 11826857
trimethyl(trityloxy)silane
CID 11067560
1-hydroxy-3,3-dimethyl-1-phenyl-1-trimethylsilyloxybutan-2-one
CID 56998630
(2,3-diphenyl-3-trimethylsilyloxybutan-2-yl)oxy-trimethylsilane
CID 10068766
2-phenyl-2-trimethylsilyloxy-2-(2-trimethylsilylphenyl)acetic acid
CID 170850849
methyl 2,2-dimethyl-3-phenyl-3-trimethylsilyloxybutanoate
CID 11098418
methyl (2R)-2-cyano-2-phenyl-2-trimethylsilyloxyacetate
CID 45379026
2-oxo-3-phenyl-3,3-bis(trimethylsilyl)propanoic acid
CID 102239962
3-methoxy-2-phenyl-2-pyrimidin-2-ylpropanoic acid
CID 121398970
ethane;2-hydroxy-2,2-diphenylacetic acid
CID 143307418
(2R)-2-hydroxy-2-phenylpropanoic acid
CID 736858
(1-acetyloxy-1-phenylethyl) acetate
CID 11586599

Frequently Asked Questions

What is the IUPAC name of (2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid?
The IUPAC name of (2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid (CID 54395913) is (2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid.
What is the SMILES notation for (2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid?
The canonical SMILES for (2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid is C[Si](C)(C)O[C@@](C(=O)O)(c1ccccc1)[Si](C)(C)C.
What is the InChIKey of (2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid?
The InChIKey is VJXWVNMCVXXROJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H24O3Si2/c1-18(2,3)14(13(15)16,17-19(4,5)6)12-10-8-7-9-11-12/h7-11H,1-6H3,(H,15,16)/t14-/m0/s1.
What are the key properties of (2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid?
(2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid has a molecular weight of 296.51 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-phenyl-2-trimethylsilyl-2-trimethylsilyloxyacetic acid is sourced from PubChem (CID 54395913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).