beryllium hydrogen phosphate

HBeO4P — CID 26127

IUPACberyllium hydrogen phosphate
SMILESO=P([O-])([O-])O.[Be+2]
InChIInChI=1S/Be.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+2;/p-2
InChIKeyXUYHBCPJXPJTCK-UHFFFAOYSA-L
MW104.99 g/mol
LogP-2.57
Rot. Bonds

About beryllium hydrogen phosphate

beryllium hydrogen phosphate (PubChem CID 26127) has the molecular formula HBeO4P and a molecular weight of 104.99 g/mol. Its IUPAC name is beryllium hydrogen phosphate.

Molecular Properties

Compound Nameberyllium hydrogen phosphate
PubChem CID26127
Molecular FormulaHBeO4P
Molecular Weight104.99 g/mol
Exact Mass104.97
IUPAC Nameberyllium hydrogen phosphate
SMILESO=P([O-])([O-])O.[Be+2]
InChIInChI=1S/Be.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+2;/p-2
InChIKeyXUYHBCPJXPJTCK-UHFFFAOYSA-L
XLogP-2.57
TPSA83.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.99
LogP ≤ 5-2.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Phosphoric Acid
CID 1004
Dihydrogenphosphate
CID 1003
Hydrogen phosphate
CID 3681305
(3H)Phosphoric acid
CID 3084191
Hydrogen phosphate;hydron
CID 172995034
Dihydrogen phosphate;hydron
CID 173209996
(~17~O_4_)Phosphoric acid
CID 16213604
Phosphoric acid (18O4, 96%) 80-85% IN water-18O
CID 71309211
CID 6857654
CID 6857654
Beryllium bis(hypophosphite)
CID 139059202
Phosphoric acid P-32
CID 71181
CID 5460551
CID 5460551

Frequently Asked Questions

What is the IUPAC name of beryllium hydrogen phosphate?
The IUPAC name of beryllium hydrogen phosphate (CID 26127) is beryllium hydrogen phosphate.
What is the SMILES notation for beryllium hydrogen phosphate?
The canonical SMILES for beryllium hydrogen phosphate is O=P([O-])([O-])O.[Be+2].
What is the InChIKey of beryllium hydrogen phosphate?
The InChIKey is XUYHBCPJXPJTCK-UHFFFAOYSA-L. The full InChI is InChI=1S/Be.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+2;/p-2.
What are the key properties of beryllium hydrogen phosphate?
beryllium hydrogen phosphate has a molecular weight of 104.99 g/mol, XLogP of -2.57, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for beryllium hydrogen phosphate is sourced from PubChem (CID 26127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).