(2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol

C23H34O2Si — CID 11474187

IUPAC(2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol
SMILESC[C@H](CO)C[C@@H](C)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C23H34O2Si/c1-19(17-24)16-20(2)18-25-26(23(3,4)5,21-12-8-6-9-13-21)22-14-10-7-11-15-22/h6-15,19-20,24H,16-18H2,1-5H3/t19-,20+/m0/s1
InChIKeyNBIHJOZBHSUWNL-VQTJNVASSA-N
MW370.61 g/mol
LogP4.22
Rot. Bonds8

About (2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol

(2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol (PubChem CID 11474187) has the molecular formula C23H34O2Si and a molecular weight of 370.61 g/mol. Its IUPAC name is (2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol.

Molecular Properties

Compound Name(2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol
PubChem CID11474187
Molecular FormulaC23H34O2Si
Molecular Weight370.61 g/mol
Exact Mass370.23
IUPAC Name(2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol
SMILESC[C@H](CO)C[C@@H](C)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C23H34O2Si/c1-19(17-24)16-20(2)18-25-26(23(3,4)5,21-12-8-6-9-13-21)22-14-10-7-11-15-22/h6-15,19-20,24H,16-18H2,1-5H3/t19-,20+/m0/s1
InChIKeyNBIHJOZBHSUWNL-VQTJNVASSA-N
XLogP4.22
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.61
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(S)-2-[(Aminomethyl-diphenyl-silanyl)-methyl]-4-methyl-pentan-1-ol
CID 44346635
3-((tert-Butyldiphenylsilyl)oxy)-2,2-dimethylpropan-1-ol
CID 11313883
Diphenyl(4-hydroxybutyl)methylsilane
CID 4583561
6-((tert-Butyldiphenylsilyl)oxy)hexan-1-ol
CID 11013734
tert-Butyl(hexyloxy)diphenylsilane
CID 11338517
(R)-4-(tert-Butyldiphenylsilyloxy)-3-methyl-1-butanol
CID 23727941
2-[[Tert-butyl(diphenyl)silyl]oxymethyl]-2-fluoropropane-1,3-diol
CID 138971112
Dibutoxy(diphenyl)silane
CID 13637536
(Z)-4-[tert-butyl(diphenyl)silyl]oxybut-2-en-1-ol
CID 5461382
1-Butanol, 4-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-
CID 10065108
3-(Tert-butyldiphenylsiloxy)propanol
CID 10245134
5-(tert-Butyldiphenylsilyloxy)pentan-1-ol
CID 10925936

Frequently Asked Questions

What is the IUPAC name of (2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol?
The IUPAC name of (2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol (CID 11474187) is (2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol.
What is the SMILES notation for (2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol?
The canonical SMILES for (2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol is C[C@H](CO)C[C@@H](C)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of (2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol?
The InChIKey is NBIHJOZBHSUWNL-VQTJNVASSA-N. The full InChI is InChI=1S/C23H34O2Si/c1-19(17-24)16-20(2)18-25-26(23(3,4)5,21-12-8-6-9-13-21)22-14-10-7-11-15-22/h6-15,19-20,24H,16-18H2,1-5H3/t19-,20+/m0/s1.
What are the key properties of (2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol?
(2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol has a molecular weight of 370.61 g/mol, XLogP of 4.22, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpentan-1-ol is sourced from PubChem (CID 11474187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).