4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol

C12H14O7Si2 — CID 140875144

IUPAC4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol
SMILESOc1ccc([Si](O)(O)O[Si](O)(O)c2ccc(O)cc2)cc1
InChIInChI=1S/C12H14O7Si2/c13-9-1-5-11(6-2-9)20(15,16)19-21(17,18)12-7-3-10(14)4-8-12/h1-8,13-18H
InChIKeySVYMCTINULVHIT-UHFFFAOYSA-N
MW326.41 g/mol
LogP-1.92
Rot. Bonds4

About 4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol

4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol (PubChem CID 140875144) has the molecular formula C12H14O7Si2 and a molecular weight of 326.41 g/mol. Its IUPAC name is 4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol.

Molecular Properties

Compound Name4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol
PubChem CID140875144
Molecular FormulaC12H14O7Si2
Molecular Weight326.41 g/mol
Exact Mass326.03
IUPAC Name4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol
SMILESOc1ccc([Si](O)(O)O[Si](O)(O)c2ccc(O)cc2)cc1
InChIInChI=1S/C12H14O7Si2/c13-9-1-5-11(6-2-9)20(15,16)19-21(17,18)12-7-3-10(14)4-8-12/h1-8,13-18H
InChIKeySVYMCTINULVHIT-UHFFFAOYSA-N
XLogP-1.92
TPSA130.61 Ų
H-Bond Donors6
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.41
LogP ≤ 5-1.92
H-Bond Donors ≤ 56
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 4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol?
The IUPAC name of 4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol (CID 140875144) is 4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol.
What is the SMILES notation for 4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol?
The canonical SMILES for 4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol is Oc1ccc([Si](O)(O)O[Si](O)(O)c2ccc(O)cc2)cc1.
What is the InChIKey of 4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol?
The InChIKey is SVYMCTINULVHIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O7Si2/c13-9-1-5-11(6-2-9)20(15,16)19-21(17,18)12-7-3-10(14)4-8-12/h1-8,13-18H.
What are the key properties of 4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol?
4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol has a molecular weight of 326.41 g/mol, XLogP of -1.92, 4 rotatable bonds, 6 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[dihydroxy-(4-hydroxyphenyl)silyl]oxy-dihydroxysilyl]phenol is sourced from PubChem (CID 140875144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).