2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol

C14H32O2Si — CID 91441933

IUPAC2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol
SMILESCCC(C)(O)C(C)COC(C)(CC)[Si](C)(C)C
InChIInChI=1S/C14H32O2Si/c1-9-13(4,15)12(3)11-16-14(5,10-2)17(6,7)8/h12,15H,9-11H2,1-8H3
InChIKeyANTKHCSBLHNCJT-UHFFFAOYSA-N
MW260.49 g/mol
LogP3.85
Rot. Bonds7

About 2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol

2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol (PubChem CID 91441933) has the molecular formula C14H32O2Si and a molecular weight of 260.49 g/mol. Its IUPAC name is 2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol.

Molecular Properties

Compound Name2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol
PubChem CID91441933
Molecular FormulaC14H32O2Si
Molecular Weight260.49 g/mol
Exact Mass260.22
IUPAC Name2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol
SMILESCCC(C)(O)C(C)COC(C)(CC)[Si](C)(C)C
InChIInChI=1S/C14H32O2Si/c1-9-13(4,15)12(3)11-16-14(5,10-2)17(6,7)8/h12,15H,9-11H2,1-8H3
InChIKeyANTKHCSBLHNCJT-UHFFFAOYSA-N
XLogP3.85
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.49
LogP ≤ 53.85
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

2-ethoxybutan-2-yl(trimethyl)silane
CID 175267736
(2S,3R)-2,3-dimethylpentane-1,3-diol
CID 15314348
2-methyl-1-(2-methylbutan-2-yloxy)-3-phosphanylpentan-3-ol
CID 87078256
3,4-dimethylnonane-3,7-diol
CID 175238278
(2S,3R)-2-bromo-3-methylpentan-3-ol
CID 130698764
2-[2-[hydroxy(dimethyl)silyl]butan-2-yloxy-dimethylsilyl]propan-2-ol
CID 90377132
(4R)-4-methoxy-3-methylhexan-3-ol
CID 156880648
methyl 3-hydroxy-3-methyl-2-propan-2-ylpentanoate
CID 62395625
(4R,6R)-6-[tert-butyl(dimethyl)silyl]oxy-3-ethyl-4-methylheptan-3-ol
CID 154722181
[2-[[(2S)-2-(3-hydroxy-2,3-dimethylpentoxy)propanoyl]amino]-2-methyl-3-prop-2-enoyloxypropyl] prop-2-enoate
CID 126547484
4-methyl-5-[(2-methylpropan-2-yl)oxy]pentane-2,2-diol
CID 143201598
3-(2-methylbutoxy)pentan-3-ol
CID 173179905

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol?
The IUPAC name of 2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol (CID 91441933) is 2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol.
What is the SMILES notation for 2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol?
The canonical SMILES for 2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol is CCC(C)(O)C(C)COC(C)(CC)[Si](C)(C)C.
What is the InChIKey of 2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol?
The InChIKey is ANTKHCSBLHNCJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O2Si/c1-9-13(4,15)12(3)11-16-14(5,10-2)17(6,7)8/h12,15H,9-11H2,1-8H3.
What are the key properties of 2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol?
2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol has a molecular weight of 260.49 g/mol, XLogP of 3.85, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1-(2-trimethylsilylbutan-2-yloxy)pentan-3-ol is sourced from PubChem (CID 91441933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).