2-aminoethanol;hydron;tetrafluoroborate

C2H8BF4NO — CID 174639869

IUPAC2-aminoethanol;hydron;tetrafluoroborate
SMILESF[B-](F)(F)F.NCCO.[H+]
InChIInChI=1S/C2H7NO.BF4/c3-1-2-4;2-1(3,4)5/h4H,1-3H2;/q;-1/p+1
InChIKeyBROUHOHSSULJRL-UHFFFAOYSA-O
MW148.90 g/mol
LogP0.35
Rot. Bonds1

About 2-aminoethanol;hydron;tetrafluoroborate

2-aminoethanol;hydron;tetrafluoroborate (PubChem CID 174639869) has the molecular formula C2H8BF4NO and a molecular weight of 148.90 g/mol. Its IUPAC name is 2-aminoethanol;hydron;tetrafluoroborate.

Molecular Properties

Compound Name2-aminoethanol;hydron;tetrafluoroborate
PubChem CID174639869
Molecular FormulaC2H8BF4NO
Molecular Weight148.90 g/mol
Exact Mass149.06
IUPAC Name2-aminoethanol;hydron;tetrafluoroborate
SMILESF[B-](F)(F)F.NCCO.[H+]
InChIInChI=1S/C2H7NO.BF4/c3-1-2-4;2-1(3,4)5/h4H,1-3H2;/q;-1/p+1
InChIKeyBROUHOHSSULJRL-UHFFFAOYSA-O
XLogP0.35
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.90
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 2-aminoethanol;hydron;tetrafluoroborate?
The IUPAC name of 2-aminoethanol;hydron;tetrafluoroborate (CID 174639869) is 2-aminoethanol;hydron;tetrafluoroborate.
What is the SMILES notation for 2-aminoethanol;hydron;tetrafluoroborate?
The canonical SMILES for 2-aminoethanol;hydron;tetrafluoroborate is F[B-](F)(F)F.NCCO.[H+].
What is the InChIKey of 2-aminoethanol;hydron;tetrafluoroborate?
The InChIKey is BROUHOHSSULJRL-UHFFFAOYSA-O. The full InChI is InChI=1S/C2H7NO.BF4/c3-1-2-4;2-1(3,4)5/h4H,1-3H2;/q;-1/p+1.
What are the key properties of 2-aminoethanol;hydron;tetrafluoroborate?
2-aminoethanol;hydron;tetrafluoroborate has a molecular weight of 148.90 g/mol, XLogP of 0.35, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethanol;hydron;tetrafluoroborate is sourced from PubChem (CID 174639869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).