phenylmethoxygallane

C7H9GaO — CID 173378988

IUPACphenylmethoxygallane
SMILES[GaH2]OCc1ccccc1
InChIInChI=1S/C7H7O.Ga.2H/c8-6-7-4-2-1-3-5-7;;;/h1-5H,6H2;;;/q-1;+1;;
InChIKeyUUCAYZGLGLIIMG-UHFFFAOYSA-N
MW178.87 g/mol
LogP0.75
Rot. Bonds2

About phenylmethoxygallane

phenylmethoxygallane (PubChem CID 173378988) has the molecular formula C7H9GaO and a molecular weight of 178.87 g/mol. Its IUPAC name is phenylmethoxygallane.

Molecular Properties

Compound Namephenylmethoxygallane
PubChem CID173378988
Molecular FormulaC7H9GaO
Molecular Weight178.87 g/mol
Exact Mass177.99
IUPAC Namephenylmethoxygallane
SMILES[GaH2]OCc1ccccc1
InChIInChI=1S/C7H7O.Ga.2H/c8-6-7-4-2-1-3-5-7;;;/h1-5H,6H2;;;/q-1;+1;;
InChIKeyUUCAYZGLGLIIMG-UHFFFAOYSA-N
XLogP0.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.87
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 66734377
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phenylmethoxysulfanyloxymethylbenzene
CID 10634174
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tribenzyl phosphite
CID 11810300
2-phenylmethoxybenzene-1,3-diol
CID 15652625

Frequently Asked Questions

What is the IUPAC name of phenylmethoxygallane?
The IUPAC name of phenylmethoxygallane (CID 173378988) is phenylmethoxygallane.
What is the SMILES notation for phenylmethoxygallane?
The canonical SMILES for phenylmethoxygallane is [GaH2]OCc1ccccc1.
What is the InChIKey of phenylmethoxygallane?
The InChIKey is UUCAYZGLGLIIMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7O.Ga.2H/c8-6-7-4-2-1-3-5-7;;;/h1-5H,6H2;;;/q-1;+1;;.
What are the key properties of phenylmethoxygallane?
phenylmethoxygallane has a molecular weight of 178.87 g/mol, XLogP of 0.75, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenylmethoxygallane is sourced from PubChem (CID 173378988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).