(2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol

C11H26O3Si — CID 154718482

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

About (2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol

(2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol (PubChem CID 154718482) has the molecular formula C11H26O3Si and a molecular weight of 234.41 g/mol. Its IUPAC name is (2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol.

Molecular Properties

Compound Name(2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol
PubChem CID154718482
Molecular FormulaC11H26O3Si
Molecular Weight234.41 g/mol
Exact Mass234.17
IUPAC Name(2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol
SMILESCC[C@@H](O)[C@H](O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O3Si/c1-7-9(12)10(13)8-14-15(5,6)11(2,3)4/h9-10,12-13H,7-8H2,1-6H3/t9-,10-/m1/s1
InChIKeyNPIABEFNIJPLLA-NXEZZACHSA-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

1-((Tert-butyldimethylsilyl)oxy)propan-2-ol
CID 13175134
5-((Tert-butyldimethylsilyl)oxy)pentan-2-ol
CID 10998500
(2R)-1-{[(1,1-Dimethylethyl)(dimethyl)silyl]oxy}propan-2-ol
CID 13175135
(S)-1-((Tert-butyldimethylsilyl)oxy)propan-2-OL
CID 13175136
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
2-([tert-Butyl(dimethyl)silyl]oxy)propan-1-ol
CID 15688070
(S)-4-(tert-butyldimethylsilyloxy)butan-2-ol
CID 10998136
4-((tert-Butyldimethylsilyl)oxy)butan-2-ol
CID 11019995
(2R)-1-(tert-butyldimethylsilyloxy)butan-2-ol
CID 11321679
(2R,3S)-2-(((Tert-butyldimethylsilyl)oxy)methyl)tetrahydrofuran-3-OL
CID 11436214

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol?
The IUPAC name of (2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol (CID 154718482) is (2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol.
What is the SMILES notation for (2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol?
The canonical SMILES for (2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol is CC[C@@H](O)[C@H](O)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of (2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol?
The InChIKey is NPIABEFNIJPLLA-NXEZZACHSA-N. The full InChI is InChI=1S/C11H26O3Si/c1-7-9(12)10(13)8-14-15(5,6)11(2,3)4/h9-10,12-13H,7-8H2,1-6H3/t9-,10-/m1/s1.
What are the key properties of (2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol?
(2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-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 (2R,3R)-1-[tert-butyl(dimethyl)silyl]oxypentane-2,3-diol is sourced from PubChem (CID 154718482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).