1,5-bis(trimethoxysilyl)pentan-3-ol

C11H28O7Si2 — CID 142667270

IUPAC1,5-bis(trimethoxysilyl)pentan-3-ol
SMILESCO[Si](CCC(O)CC[Si](OC)(OC)OC)(OC)OC
InChIInChI=1S/C11H28O7Si2/c1-13-19(14-2,15-3)9-7-11(12)8-10-20(16-4,17-5)18-6/h11-12H,7-10H2,1-6H3
InChIKeyDBFHFGNWFUYBFM-UHFFFAOYSA-N
MW328.51 g/mol
LogP0.88
Rot. Bonds12

About 1,5-bis(trimethoxysilyl)pentan-3-ol

1,5-bis(trimethoxysilyl)pentan-3-ol (PubChem CID 142667270) has the molecular formula C11H28O7Si2 and a molecular weight of 328.51 g/mol. Its IUPAC name is 1,5-bis(trimethoxysilyl)pentan-3-ol.

Molecular Properties

Compound Name1,5-bis(trimethoxysilyl)pentan-3-ol
PubChem CID142667270
Molecular FormulaC11H28O7Si2
Molecular Weight328.51 g/mol
Exact Mass328.14
IUPAC Name1,5-bis(trimethoxysilyl)pentan-3-ol
SMILESCO[Si](CCC(O)CC[Si](OC)(OC)OC)(OC)OC
InChIInChI=1S/C11H28O7Si2/c1-13-19(14-2,15-3)9-7-11(12)8-10-20(16-4,17-5)18-6/h11-12H,7-10H2,1-6H3
InChIKeyDBFHFGNWFUYBFM-UHFFFAOYSA-N
XLogP0.88
TPSA75.61 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds12
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.51
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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 1,5-bis(trimethoxysilyl)pentan-3-ol?
The IUPAC name of 1,5-bis(trimethoxysilyl)pentan-3-ol (CID 142667270) is 1,5-bis(trimethoxysilyl)pentan-3-ol.
What is the SMILES notation for 1,5-bis(trimethoxysilyl)pentan-3-ol?
The canonical SMILES for 1,5-bis(trimethoxysilyl)pentan-3-ol is CO[Si](CCC(O)CC[Si](OC)(OC)OC)(OC)OC.
What is the InChIKey of 1,5-bis(trimethoxysilyl)pentan-3-ol?
The InChIKey is DBFHFGNWFUYBFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H28O7Si2/c1-13-19(14-2,15-3)9-7-11(12)8-10-20(16-4,17-5)18-6/h11-12H,7-10H2,1-6H3.
What are the key properties of 1,5-bis(trimethoxysilyl)pentan-3-ol?
1,5-bis(trimethoxysilyl)pentan-3-ol has a molecular weight of 328.51 g/mol, XLogP of 0.88, 12 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-bis(trimethoxysilyl)pentan-3-ol is sourced from PubChem (CID 142667270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).