2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol

C10H24O2Si — CID 106324281

IUPAC2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol
SMILESCC(C)C(CO)(CO)C[Si](C)(C)C
InChIInChI=1S/C10H24O2Si/c1-9(2)10(6-11,7-12)8-13(3,4)5/h9,11-12H,6-8H2,1-5H3
InChIKeyROWOWPDQIYYCQK-UHFFFAOYSA-N
MW204.39 g/mol
LogP1.95
Rot. Bonds5

About 2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol

2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol (PubChem CID 106324281) has the molecular formula C10H24O2Si and a molecular weight of 204.39 g/mol. Its IUPAC name is 2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol.

Molecular Properties

Compound Name2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol
PubChem CID106324281
Molecular FormulaC10H24O2Si
Molecular Weight204.39 g/mol
Exact Mass204.15
IUPAC Name2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol
SMILESCC(C)C(CO)(CO)C[Si](C)(C)C
InChIInChI=1S/C10H24O2Si/c1-9(2)10(6-11,7-12)8-13(3,4)5/h9,11-12H,6-8H2,1-5H3
InChIKeyROWOWPDQIYYCQK-UHFFFAOYSA-N
XLogP1.95
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.39
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-heptyl-2-propan-2-ylpropane-1,3-diol
CID 79450915
2-hexyl-2-propan-2-ylpropane-1,3-diol
CID 79450743
2-decyl-2-propan-2-ylpropane-1,3-diol
CID 79450466
2-[(dimethylamino)methyl]-4-methyl-2-propan-2-ylpentan-1-ol
CID 139652444
2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpropane-1,3-diol
CID 112592507
2-[(5-ethylthiophen-2-yl)methyl]-2-propan-2-ylpropane-1,3-diol
CID 79450205
2-ethyl-2-(hydroxymethyl)-3-methylbutane-1,4-diol
CID 87645352
N,2,3-trimethyl-2-(trimethylsilylmethyl)butan-1-amine
CID 106323915
2-(aminomethyl)-2-(2-ethylsulfanylethyl)-3-methylbutan-1-ol
CID 106507686
2-(aminomethyl)-3-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]butan-1-ol
CID 106507565
2-[(4-chloro-1,3-dimethylpyrazol-5-yl)methyl]-2-propan-2-ylpropane-1,3-diol
CID 79449846
2-[(3-bromo-2,6-difluorophenyl)methyl]-2-propan-2-ylpropane-1,3-diol
CID 114166996

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol?
The IUPAC name of 2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol (CID 106324281) is 2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol.
What is the SMILES notation for 2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol?
The canonical SMILES for 2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol is CC(C)C(CO)(CO)C[Si](C)(C)C.
What is the InChIKey of 2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol?
The InChIKey is ROWOWPDQIYYCQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24O2Si/c1-9(2)10(6-11,7-12)8-13(3,4)5/h9,11-12H,6-8H2,1-5H3.
What are the key properties of 2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol?
2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol has a molecular weight of 204.39 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-2-(trimethylsilylmethyl)propane-1,3-diol is sourced from PubChem (CID 106324281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).