bromo fluoro hydrogen phosphate

HBrFO4P — CID 174047934

IUPACbromo fluoro hydrogen phosphate
SMILESO=P(O)(OF)OBr
InChIInChI=1S/BrFHO4P/c1-5-7(3,4)6-2/h(H,3,4)
InChIKeyWZKGKVPHXRGDQP-UHFFFAOYSA-N
MW194.88 g/mol
LogP1.31
Rot. Bonds2

About bromo fluoro hydrogen phosphate

bromo fluoro hydrogen phosphate (PubChem CID 174047934) has the molecular formula HBrFO4P and a molecular weight of 194.88 g/mol. Its IUPAC name is bromo fluoro hydrogen phosphate.

Molecular Properties

Compound Namebromo fluoro hydrogen phosphate
PubChem CID174047934
Molecular FormulaHBrFO4P
Molecular Weight194.88 g/mol
Exact Mass193.88
IUPAC Namebromo fluoro hydrogen phosphate
SMILESO=P(O)(OF)OBr
InChIInChI=1S/BrFHO4P/c1-5-7(3,4)6-2/h(H,3,4)
InChIKeyWZKGKVPHXRGDQP-UHFFFAOYSA-N
XLogP1.31
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.88
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze bromo fluoro hydrogen phosphate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

bromo phosphono hydrogen phosphate
CID 129216987
fluoro methyl hydrogen phosphate
CID 87128109
fluoro dihydrogen phosphate;iron
CID 173042796
fluoro dihydrogen phosphate;platinum
CID 174846501
bromo [hydroperoxy(hydroxy)phosphoryl] hydrogen phosphate
CID 173006116
[fluorooxy(hydroxy)phosphoryl] acetate
CID 54246379
fluoro propan-2-yl hydrogen phosphate
CID 22590861
calcium;fluoro dihydrogen phosphate;hydride
CID 174626748
ethene;fluoro dihydrogen phosphate
CID 87187087
sodium;fluoro dihydrogen phosphate;hydride;iron
CID 173004802
chloro(fluorooxy)phosphinic acid;chlorophosphonic acid
CID 175540690
calcium;magnesium;fluoro dihydrogen phosphate;hydride
CID 174988719

Frequently Asked Questions

What is the IUPAC name of bromo fluoro hydrogen phosphate?
The IUPAC name of bromo fluoro hydrogen phosphate (CID 174047934) is bromo fluoro hydrogen phosphate.
What is the SMILES notation for bromo fluoro hydrogen phosphate?
The canonical SMILES for bromo fluoro hydrogen phosphate is O=P(O)(OF)OBr.
What is the InChIKey of bromo fluoro hydrogen phosphate?
The InChIKey is WZKGKVPHXRGDQP-UHFFFAOYSA-N. The full InChI is InChI=1S/BrFHO4P/c1-5-7(3,4)6-2/h(H,3,4).
What are the key properties of bromo fluoro hydrogen phosphate?
bromo fluoro hydrogen phosphate has a molecular weight of 194.88 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bromo fluoro hydrogen phosphate is sourced from PubChem (CID 174047934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).