Boron Phosphate

CAS: 13308-51-5 · BO4P

2D Structure

Loading 3D structure...

CAS Registry Number

13308-51-5

SMILES

O=P12OB(O1)O2

InChI Key

RKVCQBPDVHFKCU-UHFFFAOYSA-N

InChI

InChI=1S/BO4P/c2-6-3-1(4-6)5-6

Comprehensive physical and chemical properties

Property	Value	Source
Density	2.82 g/cm³	CAS Common Chemistry
	2.82 g/cm3	CAS Common Chemistry
Wikipedia Url	https://en.wikipedia.org/wiki/Boron_phosphate	CAS Common Chemistry
Canonical SMILES	O=P12OB(O1)O2	CAS Common Chemistry
InChI	InChI=1S/BO4P/c2-6-3-1(4-6)5-6	CAS Common Chemistry
InChI Key	InChIKey=RKVCQBPDVHFKCU-UHFFFAOYSA-N	CAS Common Chemistry
Name	Boron phosphate	CAS Common Chemistry
Molecular Mass	105.782 g/mol	RDKit
	105.96272551000001 g/mol	RDKit
	105.78 g/mol	chempirical lib
Heavy Atom Count	6	RDKit
Hydrogen Bond Acceptors	4	RDKit
Hydrogen Bond Donors	0	RDKit
Rotatable Bonds	0	RDKit
Aromatic Ring Count	0	RDKit
Topological Polar Surface Area	44.760000000000005 Å²	RDKit
	44.76 Å²	RDKit
LogP	0.15639999999999987	RDKit
	0.1564	RDKit
Molar Refractivity	16.6155 cm³/mol	RDKit
Ring Count	3	RDKit
Formal Charge	0	RDKit
Fraction Csp3	0.0	RDKit
Exact Mass	105.78 g/mol	CAS Common Chemistry

NMR, IR, and Mass spectral data

Predicting NMR spectra...

10 ppm 9 8 7 6 5 4 3 2 1 0 ppm

Shift (ppm)	Multiplicity	Integration	Assignment

200 ppm 180 160 140 120 100 80 60 40 20 0 ppm

Shift (ppm)	DEPT	Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

Convert

MW = 105.78 g/mol; density = 2.820 g/mL. Edit any field — others recompute live.

Mass (g) Moles (mmol) Moles (mol) Volume (mL)