tris[2-(methoxymethoxy)phenyl]bismuthane

C24H27BiO6 — CID 10579730

IUPACtris[2-(methoxymethoxy)phenyl]bismuthane
SMILESCOCOc1ccccc1[Bi](c1ccccc1OCOC)c1ccccc1OCOC
InChIInChI=1S/3C8H9O2.Bi/c3*1-9-7-10-8-5-3-2-4-6-8;/h3*2-5H,7H2,1H3;
InChIKeyUERVDKGNMZIXDA-UHFFFAOYSA-N
MW620.45 g/mol
LogP2.15
Rot. Bonds12

About tris[2-(methoxymethoxy)phenyl]bismuthane

tris[2-(methoxymethoxy)phenyl]bismuthane (PubChem CID 10579730) has the molecular formula C24H27BiO6 and a molecular weight of 620.45 g/mol. Its IUPAC name is tris[2-(methoxymethoxy)phenyl]bismuthane.

Molecular Properties

Compound Nametris[2-(methoxymethoxy)phenyl]bismuthane
PubChem CID10579730
Molecular FormulaC24H27BiO6
Molecular Weight620.45 g/mol
Exact Mass620.16
IUPAC Nametris[2-(methoxymethoxy)phenyl]bismuthane
SMILESCOCOc1ccccc1[Bi](c1ccccc1OCOC)c1ccccc1OCOC
InChIInChI=1S/3C8H9O2.Bi/c3*1-9-7-10-8-5-3-2-4-6-8;/h3*2-5H,7H2,1H3;
InChIKeyUERVDKGNMZIXDA-UHFFFAOYSA-N
XLogP2.15
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500620.45
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-bromo-2-(methoxymethoxy)benzene;ethane
CID 91232598
2-(methoxymethoxy)benzonitrile
CID 10352018
1-(methoxymethoxy)-2-prop-2-enoxybenzene
CID 121218141
[2-(methoxymethoxy)phenyl]methanol
CID 10920904
2-ethyl-1,3-bis(methoxymethoxy)benzene
CID 141101427
dimethoxy-[2-(methoxymethoxy)phenyl]borane
CID 123184481
1-bis[2-(methoxymethoxy)phenyl]phosphoryl-2-(methoxymethoxy)benzene
CID 84820824
2,2-difluoro-1-[2-(methoxymethoxy)phenyl]ethanone
CID 171367812
2-bromo-1-chloro-3-(methoxymethoxy)benzene
CID 164894389
triethyl-[2-(methoxymethoxy)phenyl]silane
CID 69371927
1-[2-(methoxymethoxy)phenyl]-2,3-dimethyl-4-phenylbenzene
CID 151399020
2-(methoxymethoxy)benzenesulfonyl chloride
CID 131454177

Frequently Asked Questions

What is the IUPAC name of tris[2-(methoxymethoxy)phenyl]bismuthane?
The IUPAC name of tris[2-(methoxymethoxy)phenyl]bismuthane (CID 10579730) is tris[2-(methoxymethoxy)phenyl]bismuthane.
What is the SMILES notation for tris[2-(methoxymethoxy)phenyl]bismuthane?
The canonical SMILES for tris[2-(methoxymethoxy)phenyl]bismuthane is COCOc1ccccc1[Bi](c1ccccc1OCOC)c1ccccc1OCOC.
What is the InChIKey of tris[2-(methoxymethoxy)phenyl]bismuthane?
The InChIKey is UERVDKGNMZIXDA-UHFFFAOYSA-N. The full InChI is InChI=1S/3C8H9O2.Bi/c3*1-9-7-10-8-5-3-2-4-6-8;/h3*2-5H,7H2,1H3;.
What are the key properties of tris[2-(methoxymethoxy)phenyl]bismuthane?
tris[2-(methoxymethoxy)phenyl]bismuthane has a molecular weight of 620.45 g/mol, XLogP of 2.15, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tris[2-(methoxymethoxy)phenyl]bismuthane is sourced from PubChem (CID 10579730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).