(2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol

C11H26O3Si — CID 11579557

IUPAC(2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol
SMILESC[C@H](C[C@H](O)CO)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O3Si/c1-9(7-10(13)8-12)14-15(5,6)11(2,3)4/h9-10,12-13H,7-8H2,1-6H3/t9-,10+/m1/s1
InChIKeyLATLBCQGZKSGOL-ZJUUUORDSA-N
MW234.41 g/mol
LogP2.14
Rot. Bonds5

About (2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol

(2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol (PubChem CID 11579557) has the molecular formula C11H26O3Si and a molecular weight of 234.41 g/mol. Its IUPAC name is (2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol.

Molecular Properties

Compound Name(2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol
PubChem CID11579557
Molecular FormulaC11H26O3Si
Molecular Weight234.41 g/mol
Exact Mass234.17
IUPAC Name(2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol
SMILESC[C@H](C[C@H](O)CO)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O3Si/c1-9(7-10(13)8-12)14-15(5,6)11(2,3)4/h9-10,12-13H,7-8H2,1-6H3/t9-,10+/m1/s1
InChIKeyLATLBCQGZKSGOL-ZJUUUORDSA-N
XLogP2.14
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.41
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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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
4-((tert-Butyldimethylsilyl)oxy)butan-2-ol
CID 11019995
1-Butanol, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, (3R)-
CID 11052750
2-([tert-Butyl(dimethyl)silyl]oxy)propan-1-ol
CID 15688070
(S)-4-(tert-butyldimethylsilyloxy)butan-2-ol
CID 10998136
(2R)-1-(tert-butyldimethylsilyloxy)butan-2-ol
CID 11321679
(2R)-3-{[tert-Butyl(dimethyl)silyl]oxy}propane-1,2-diol
CID 13552567
(S)-2-(tert-Butyl-dimethyl-silanyloxy)-propan-1-ol
CID 15688069
cis-(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentan-1-ol
CID 16732844
(1S,3R)-3-{[tert-Butyl(dimethyl)silyl]oxy}cyclopentan-1-ol
CID 54118351

Frequently Asked Questions

What is the IUPAC name of (2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol?
The IUPAC name of (2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol (CID 11579557) is (2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol.
What is the SMILES notation for (2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol?
The canonical SMILES for (2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol is C[C@H](C[C@H](O)CO)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of (2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol?
The InChIKey is LATLBCQGZKSGOL-ZJUUUORDSA-N. The full InChI is InChI=1S/C11H26O3Si/c1-9(7-10(13)8-12)14-15(5,6)11(2,3)4/h9-10,12-13H,7-8H2,1-6H3/t9-,10+/m1/s1.
What are the key properties of (2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol?
(2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol has a molecular weight of 234.41 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypentane-1,2-diol is sourced from PubChem (CID 11579557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).