ethoxyethane;fluoroboronic acid

C4H18B4F4O9 — CID 173008541

IUPACethoxyethane;fluoroboronic acid
SMILESCCOCC.OB(O)F.OB(O)F.OB(O)F.OB(O)F
InChIInChI=1S/C4H10O.4BFH2O2/c1-3-5-4-2;4*2-1(3)4/h3-4H2,1-2H3;4*3-4H
InChIKeyGWAOPLUJGVVTLL-UHFFFAOYSA-N
MW329.42 g/mol
LogP-3.26
Rot. Bonds2

About ethoxyethane;fluoroboronic acid

ethoxyethane;fluoroboronic acid (PubChem CID 173008541) has the molecular formula C4H18B4F4O9 and a molecular weight of 329.42 g/mol. Its IUPAC name is ethoxyethane;fluoroboronic acid.

Molecular Properties

Compound Nameethoxyethane;fluoroboronic acid
PubChem CID173008541
Molecular FormulaC4H18B4F4O9
Molecular Weight329.42 g/mol
Exact Mass330.13
IUPAC Nameethoxyethane;fluoroboronic acid
SMILESCCOCC.OB(O)F.OB(O)F.OB(O)F.OB(O)F
InChIInChI=1S/C4H10O.4BFH2O2/c1-3-5-4-2;4*2-1(3)4/h3-4H2,1-2H3;4*3-4H
InChIKeyGWAOPLUJGVVTLL-UHFFFAOYSA-N
XLogP-3.26
TPSA171.07 Ų
H-Bond Donors8
H-Bond Acceptors9
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.42
LogP ≤ 5-3.26
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

ethoxyethane;fluoroboronic acid
CID 173104049
ethoxyethane;molybdenum;tetrahydrochloride
CID 174873486
ethoxyethane;titanium;trihydrochloride
CID 173160344
ethoxyethane
CID 18694919
ethoxyethane
CID 19002445
ethoxyethane;hydroxylamine
CID 135816400
barium(2+);ethoxyethane;titanium;tetrahydroxide
CID 18003952
ethanol;fluoroboronic acid
CID 173291774
dichloromethane;ethoxyethane;methanol;hydrochloride
CID 131723053
ethoxyethane;sulfane
CID 87243372
ethoxyethane;sulfane
CID 90240371
ethoxyethane;pentahydrate
CID 141041283

Frequently Asked Questions

What is the IUPAC name of ethoxyethane;fluoroboronic acid?
The IUPAC name of ethoxyethane;fluoroboronic acid (CID 173008541) is ethoxyethane;fluoroboronic acid.
What is the SMILES notation for ethoxyethane;fluoroboronic acid?
The canonical SMILES for ethoxyethane;fluoroboronic acid is CCOCC.OB(O)F.OB(O)F.OB(O)F.OB(O)F.
What is the InChIKey of ethoxyethane;fluoroboronic acid?
The InChIKey is GWAOPLUJGVVTLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.4BFH2O2/c1-3-5-4-2;4*2-1(3)4/h3-4H2,1-2H3;4*3-4H.
What are the key properties of ethoxyethane;fluoroboronic acid?
ethoxyethane;fluoroboronic acid has a molecular weight of 329.42 g/mol, XLogP of -3.26, 2 rotatable bonds, 8 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;fluoroboronic acid is sourced from PubChem (CID 173008541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).