(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol

C12H28O2Si — CID 14590718

IUPAC(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol
SMILESCC[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](C)CO
InChIInChI=1S/C12H28O2Si/c1-8-11(10(2)9-13)14-15(6,7)12(3,4)5/h10-11,13H,8-9H2,1-7H3/t10-,11-/m1/s1
InChIKeyZYDONJFMVJGOQA-GHMZBOCLSA-N
MW232.44 g/mol
LogP3.42
Rot. Bonds5

About (2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol

(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol (PubChem CID 14590718) has the molecular formula C12H28O2Si and a molecular weight of 232.44 g/mol. Its IUPAC name is (2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol.

Molecular Properties

Compound Name(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol
PubChem CID14590718
Molecular FormulaC12H28O2Si
Molecular Weight232.44 g/mol
Exact Mass232.19
IUPAC Name(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol
SMILESCC[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](C)CO
InChIInChI=1S/C12H28O2Si/c1-8-11(10(2)9-13)14-15(6,7)12(3,4)5/h10-11,13H,8-9H2,1-7H3/t10-,11-/m1/s1
InChIKeyZYDONJFMVJGOQA-GHMZBOCLSA-N
XLogP3.42
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.44
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol 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

5-((Tert-butyldimethylsilyl)oxy)pentan-2-ol
CID 10998500
1-Butanol, 3-t-butyldimethylsilyloxy-
CID 554645
3-(tert-Butyldimethylsilanyloxy)pentane-1,5-diol
CID 10868252
1-Butanol, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, (3R)-
CID 11052750
(2S,4R)-5-[tert-butyl(dimethyl)silyl]oxy-2,4-dimethylpentan-1-ol
CID 10444620
trans-2-(t-Butyldimethylsilyloxymethyl)cyclopentanol
CID 11053444
5-((t-Butyldimethylsilyl)oxy)-2,4-dimethylpentan-1-ol
CID 13596692
(S)-4-(tert-butyldimethylsilyloxy)butan-2-ol
CID 10998136
4-((tert-Butyldimethylsilyl)oxy)butan-2-ol
CID 11019995
(2S,3S)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylpentan-1-ol
CID 11035844
4-[Tert-butyl(dimethyl)silyl]oxy-4-methylpentan-2-ol
CID 15124201
(2S,3S,4S)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2,4-dimethylpentan-1-ol
CID 91394804

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol?
The IUPAC name of (2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol (CID 14590718) is (2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol.
What is the SMILES notation for (2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol?
The canonical SMILES for (2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol is CC[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](C)CO.
What is the InChIKey of (2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol?
The InChIKey is ZYDONJFMVJGOQA-GHMZBOCLSA-N. The full InChI is InChI=1S/C12H28O2Si/c1-8-11(10(2)9-13)14-15(6,7)12(3,4)5/h10-11,13H,8-9H2,1-7H3/t10-,11-/m1/s1.
What are the key properties of (2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol?
(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol has a molecular weight of 232.44 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-1-ol is sourced from PubChem (CID 14590718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).