1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol

C15H36O3Si2 — CID 10758091

IUPAC1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol
SMILESCC(C)(C)[Si](C)(C)OCC(O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H36O3Si2/c1-14(2,3)19(7,8)17-11-13(16)12-18-20(9,10)15(4,5)6/h13,16H,11-12H2,1-10H3
InChIKeyBICVCKKJDDTEIV-UHFFFAOYSA-N
MW320.62 g/mol
LogP4.39
Rot. Bonds6

About 1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol

1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol (PubChem CID 10758091) has the molecular formula C15H36O3Si2 and a molecular weight of 320.62 g/mol. Its IUPAC name is 1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol.

Molecular Properties

Compound Name1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol
PubChem CID10758091
Molecular FormulaC15H36O3Si2
Molecular Weight320.62 g/mol
Exact Mass320.22
IUPAC Name1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol
SMILESCC(C)(C)[Si](C)(C)OCC(O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H36O3Si2/c1-14(2,3)19(7,8)17-11-13(16)12-18-20(9,10)15(4,5)6/h13,16H,11-12H2,1-10H3
InChIKeyBICVCKKJDDTEIV-UHFFFAOYSA-N
XLogP4.39
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.62
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol?
The IUPAC name of 1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol (CID 10758091) is 1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol.
What is the SMILES notation for 1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol?
The canonical SMILES for 1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol is CC(C)(C)[Si](C)(C)OCC(O)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol?
The InChIKey is BICVCKKJDDTEIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H36O3Si2/c1-14(2,3)19(7,8)17-11-13(16)12-18-20(9,10)15(4,5)6/h13,16H,11-12H2,1-10H3.
What are the key properties of 1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol?
1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol has a molecular weight of 320.62 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis[[tert-butyl(dimethyl)silyl]oxy]propan-2-ol is sourced from PubChem (CID 10758091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).