boric acid;triethoxy(phenyl)silane

C12H23BO6Si — CID 174800585

IUPACboric acid;triethoxy(phenyl)silane
SMILESCCO[Si](OCC)(OCC)c1ccccc1.OB(O)O
InChIInChI=1S/C12H20O3Si.BH3O3/c1-4-13-16(14-5-2,15-6-3)12-10-8-7-9-11-12;2-1(3)4/h7-11H,4-6H2,1-3H3;2-4H
InChIKeyHTALHOJYMXUVJI-UHFFFAOYSA-N
MW302.21 g/mol
LogP-0.11
Rot. Bonds7

About boric acid;triethoxy(phenyl)silane

boric acid;triethoxy(phenyl)silane (PubChem CID 174800585) has the molecular formula C12H23BO6Si and a molecular weight of 302.21 g/mol. Its IUPAC name is boric acid;triethoxy(phenyl)silane.

Molecular Properties

Compound Nameboric acid;triethoxy(phenyl)silane
PubChem CID174800585
Molecular FormulaC12H23BO6Si
Molecular Weight302.21 g/mol
Exact Mass302.14
IUPAC Nameboric acid;triethoxy(phenyl)silane
SMILESCCO[Si](OCC)(OCC)c1ccccc1.OB(O)O
InChIInChI=1S/C12H20O3Si.BH3O3/c1-4-13-16(14-5-2,15-6-3)12-10-8-7-9-11-12;2-1(3)4/h7-11H,4-6H2,1-3H3;2-4H
InChIKeyHTALHOJYMXUVJI-UHFFFAOYSA-N
XLogP-0.11
TPSA88.38 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.21
LogP ≤ 5-0.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

ethane;triethoxy(phenyl)silane
CID 174836592
silane;triethoxy(phenyl)silane;hydrofluoride
CID 174494492
fluorosilane;triethoxy(phenyl)silane
CID 174494490
[diethoxy(phenyl)silyl]oxy-diethoxy-phenylsilane
CID 14533277
dimethoxy(diphenyl)silane;triethoxy(phenyl)silane
CID 174286071
triethoxy-[4-(4-phenylphenyl)phenyl]silane
CID 59687607
2-[ethoxy-phenyl-(2-sulfanylethoxy)silyl]oxyethanethiol
CID 153327930
phenyl-tri(propan-2-yloxy)silane;triethoxy(phenyl)silane
CID 159737253
3-[diethoxy(phenyl)silyl]oxypropane-1-thiol
CID 87401013
2-(ethoxy-methoxy-phenylsilyl)oxyethanol
CID 140892700
diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane
CID 53432346
ethoxy-(ethoxy-methyl-phenylsilyl)-methyl-phenylsilane
CID 19809309

Frequently Asked Questions

What is the IUPAC name of boric acid;triethoxy(phenyl)silane?
The IUPAC name of boric acid;triethoxy(phenyl)silane (CID 174800585) is boric acid;triethoxy(phenyl)silane.
What is the SMILES notation for boric acid;triethoxy(phenyl)silane?
The canonical SMILES for boric acid;triethoxy(phenyl)silane is CCO[Si](OCC)(OCC)c1ccccc1.OB(O)O.
What is the InChIKey of boric acid;triethoxy(phenyl)silane?
The InChIKey is HTALHOJYMXUVJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O3Si.BH3O3/c1-4-13-16(14-5-2,15-6-3)12-10-8-7-9-11-12;2-1(3)4/h7-11H,4-6H2,1-3H3;2-4H.
What are the key properties of boric acid;triethoxy(phenyl)silane?
boric acid;triethoxy(phenyl)silane has a molecular weight of 302.21 g/mol, XLogP of -0.11, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for boric acid;triethoxy(phenyl)silane is sourced from PubChem (CID 174800585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).