Product Name

  • Name

    Phosphoric acid-d3

  • EINECS 238-285-0
  • CAS No. 14335-33-2
  • Article Data17
  • CAS DataBase
  • Density 2.235 g/cm3
  • Solubility
  • Melting Point 41-44 °C(lit.)
  • Formula H3O4P
  • Boiling Point 157.999 °C at 760 mmHg
  • Molecular Weight 100.971
  • Flash Point
  • Transport Information UN 1805 8
  • Appearance clear colorless solution
  • Safety 26-36/37/39-45
  • Risk Codes 34
  • Molecular Structure Molecular Structure of 14335-33-2 (Phosphoric acid-d3)
  • Hazard Symbols CorrosiveC
  • Synonyms Deuteriumphosphate (D3PO4);Phosphoric acid-d3(6CI,7CI,8CI,9CI);
  • PSA 87.57000
  • LogP -0.92860

Synthetic route

deuterophosphorous acid
57583-55-8

deuterophosphorous acid

tripropylammonium fluorochromate (VI)

tripropylammonium fluorochromate (VI)

A

C5H5NH(1+)*CrO2F(1-)=C5H5NHCrO2F

C5H5NH(1+)*CrO2F(1-)=C5H5NHCrO2F

B

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

Conditions
ConditionsYield
In dimethyl sulfoxide Kinetics; React. between 298 and 318 K.; Monitored spectrophotometrically at 356 nm.;
barium phosphate

barium phosphate

sulfuric acid-d2
13813-19-9

sulfuric acid-d2

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

Conditions
ConditionsYield
formation from diluted (2)H2SO4 and Ba3(PO4)2;;
tert.-butylhydroperoxide
75-91-2

tert.-butylhydroperoxide

phosphorous
12185-10-3

phosphorous

water-d2
7789-20-0

water-d2

A

trideutero hypophosphorous acid
57583-56-9

trideutero hypophosphorous acid

B

deuterophosphorous acid
57583-55-8

deuterophosphorous acid

C

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

Conditions
ConditionsYield
In water-d2; toluene Kinetics; Ar, P4 (or soln. of P4 in toluene) added in small portions, heated to 25-60°C, stirred for 0.5-4 h; not isolated, detected by NMR;
In tetrahydrofuran; water-d2 Kinetics; Ar, P4 added in small portions, heated to 60°C, stirred for 0.5-4h; not isolated, detected by NMR;
In tetrachloromethane; water-d2 Kinetics; Ar, P4 added in small portions, heated to 60°C, stirred for 0.5-4h; not isolated, detected by NMR;
In hexane; water-d2 Kinetics; Ar, P4 added in small portions, heated to 60°C, stirred for 0.5-4h; not isolated, detected by NMR;
In water-d2 Kinetics; Ar, P4 added in small portions, heated to 90°C, stirred for 0.5-4h; not isolated, detected by NMR;
phosphorous
12185-10-3

phosphorous

dihydrogen peroxide
7722-84-1

dihydrogen peroxide

water-d2
7789-20-0

water-d2

A

trideutero hypophosphorous acid
57583-56-9

trideutero hypophosphorous acid

B

deuterophosphorous acid
57583-55-8

deuterophosphorous acid

C

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

Conditions
ConditionsYield
In water-d2 Kinetics; Ar, P4 added in small portions, heated to 25-90°C, stirred for 0.5-4 h; not isolated, detected by NMR;
phosphorous
12185-10-3

phosphorous

water-d2
7789-20-0

water-d2

dibenzoyl peroxide
94-36-0

dibenzoyl peroxide

A

trideutero hypophosphorous acid
57583-56-9

trideutero hypophosphorous acid

B

deuterophosphorous acid
57583-55-8

deuterophosphorous acid

C

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

Conditions
ConditionsYield
In water-d2; toluene Kinetics; Ar, P4 (or soln. of P4 in toluene) added in small portions, heated to 60-60°C, stirred for 0.5-4 h; not isolated, detected by NMR;
copper diacetate In water-d2; toluene Kinetics; Ar, P4 added in small portions, heated to 60°C, stirred for 0.5-4h; not isolated, detected by NMR;
copper(l) iodide In water-d2; toluene Kinetics; Ar, P4 added in small portions, heated to 60°C, stirred for 0.5-4h; not isolated, detected by NMR;
water-d2
7789-20-0

water-d2

phosphorus pentoxide

phosphorus pentoxide

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

Conditions
ConditionsYield
stoich. amts.;
In neat (no solvent)
In water-d2 P-compd. dissoln.;
water-d2
7789-20-0

water-d2

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

Conditions
ConditionsYield
In neat (no solvent) formation of diluted soln. with POCl3 and excess (2)H2O;;
P4O10

P4O10

water-d2
7789-20-0

water-d2

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

Conditions
ConditionsYield
In water-d2
phosphorus pentoxide
16752-60-6

phosphorus pentoxide

water-d2
7789-20-0

water-d2

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

Conditions
ConditionsYield
In water sublimated P4O10 converted with ultrapure D2O in moisturizing apparatus; filtered through G5 sintered glass frit under CO2-free atmosphere;
deuterophosphorous acid
57583-55-8

deuterophosphorous acid

tetraethylammonium chlorochromate(VI)

tetraethylammonium chlorochromate(VI)

A

tetraethylammonium chlorochromate(IV)

tetraethylammonium chlorochromate(IV)

B

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

Conditions
ConditionsYield
In dimethyl sulfoxide Kinetics; react. of (2)HP(O)(O(2)H)2 with O2CrOCl at 298 K; detd. spectrophotometrically;
vanadium(V) oxide
788133-24-4

vanadium(V) oxide

water-d2
7789-20-0

water-d2

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

vanadium(IV) hydrogen phosphate hemihydrate

vanadium(IV) hydrogen phosphate hemihydrate

Conditions
ConditionsYield
In ethyl [2]alcohol Reflux with stirring for 11 days;; filtered, solid was washed with D2O, dried in vac. at 60°C for 16 h; elem. anal.;;98.8%
sodium cyclopentadienylchromium tricarbonyl

sodium cyclopentadienylchromium tricarbonyl

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

DCr(CO)3Cp

DCr(CO)3Cp

Conditions
ConditionsYield
In tetrahydrofuran; water-d2 D3PO4 in D2O added to a soln. of Cr complex in THF, stirred for 45 min; evapd. (vac.), sublimed;54%
sodium tetrahydroborate
16940-66-2

sodium tetrahydroborate

Ru3(CO)9(N2(CH3)2)
135584-76-8

Ru3(CO)9(N2(CH3)2)

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

(2)HRu3(CO)9(CH3NN(2)HCH3)

(2)HRu3(CO)9(CH3NN(2)HCH3)

Conditions
ConditionsYield
With {18}crown-6 In tetrahydrofuran Ru-compd., NaBH4 and (18)crown-6 in THF stirred for 2.5 h at room temp., addn. of D3PO4, stirred for 5 min; excess D3PO4 neutralized with NaHCO3, dried with MgSO4, filtered, removal of solvent in vac., dissolved in CH2Cl2, TLC (hexane/CH2Cl2 7:3);30%
potassium tetracarbonylcobaltate
14878-26-3

potassium tetracarbonylcobaltate

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

A

CH2CHCH(CH2CH2D)Co(CO)3

CH2CHCH(CH2CH2D)Co(CO)3

B

CH(CH3)CHCH(CH2D)Co(CO)3

CH(CH3)CHCH(CH2D)Co(CO)3

Conditions
ConditionsYield
With CH2CHCH2CHCH2 In not given mechanism discussed;;A n/a
B 10%
With CH2CHCH2CHCH2 In not given mechanism discussed;;A n/a
B 10%
potassium tetracarbonylcobaltate
14878-26-3

potassium tetracarbonylcobaltate

1,4-Pentadiene
591-93-5

1,4-Pentadiene

water-d2
7789-20-0

water-d2

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

A

CH2CHCH(CH2CH2D)Co(CO)3

CH2CHCH(CH2CH2D)Co(CO)3

B

CH(CH3)CHCH(CH2D)Co(CO)3

CH(CH3)CHCH(CH2D)Co(CO)3

Conditions
ConditionsYield
In water-d2 mechanism discussed;;A n/a
B 5%
In water-d2 mechanism discussed;;A n/a
B 5%
potassium cyanide

potassium cyanide

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

hydrogen cyanide
3017-23-0

hydrogen cyanide

Conditions
ConditionsYield
In neat (no solvent) vac. system.;
In neat (no solvent) action of perdeuterophosphoric acid on potassium cyanide in vac.;
With P2O5 In neat (no solvent) action of D3PO4 (with excess P2O5 added) on KCN in vac.;
potassium carbonate
584-08-7

potassium carbonate

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

deuterated potassium dihydrogen phosphate
13761-79-0

deuterated potassium dihydrogen phosphate

Conditions
ConditionsYield
prior synthesis carbonate dehydration for 2 h at 150°C;
sodium azide

sodium azide

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

hydrazoic acid
14989-19-6

hydrazoic acid

Conditions
ConditionsYield
In neat (no solvent) mixing (excess of NaN3); not pure; mass spectroscopy;
In further solvent(s) NaN3 reacted with excess D3PO4 under vac.; mass spectrum;
distn., FTIR anal. of purity;
silver cyanide

silver cyanide

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

C(2)H(14)N

C(2)H(14)N

Conditions
ConditionsYield
adding H3PO4 to KC(15)N in vac., condensing gas evolved;
iron sulfide

iron sulfide

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

deuterium sulfide
13536-94-2

deuterium sulfide

Conditions
ConditionsYield
In water-d2 reaction of P-compd. soln. with Fe-compd. in deuterated vac. line;
water-d2
7789-20-0

water-d2

zinc sulfide

zinc sulfide

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

deuterium sulfide
13536-94-2

deuterium sulfide

Conditions
ConditionsYield
In water-d2 condensing (-196°C, on a vac. line); vac. distn. (-20°C);
sodium cyanide
773837-37-9

sodium cyanide

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

hydrogen cyanide
3017-23-0

hydrogen cyanide

Conditions
ConditionsYield
In water-d2 slow addn. of NaCN/D2O to stirred soln. of (2)H3PO4/D2O; dried (P2O5);
In water-d2 in vac.; trap-to-trap distn.;
sodium formate
3996-15-4

sodium formate

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

dideuterioformic acid
920-42-3

dideuterioformic acid

Conditions
ConditionsYield
In neat (no solvent) distillation of DCOONa with an excess of D3PO4;;
potassium cyanate
590-28-3

potassium cyanate

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

deuterio-isocyanic acid
10357-59-2

deuterio-isocyanic acid

Conditions
ConditionsYield
In water-d2 vac.; vapor condensation, distillation;
In not given byproducts: D2O; distn.;
rubidium carbonate

rubidium carbonate

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

deuterated rubidium dihydrogen phosphate
13775-96-7

deuterated rubidium dihydrogen phosphate

Conditions
ConditionsYield
prior synthesis carbonate dehydration for 2 h at 350°C;
byproducts: CO2, D2O;
byproducts: D2O, CO2;
byproducts: (2H)2O, CO2;
ammonium-d4 deuteroxide
14067-21-1

ammonium-d4 deuteroxide

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

deuterated ammonium dihydrogen phosphate
14989-27-6

deuterated ammonium dihydrogen phosphate

Conditions
ConditionsYield
byproducts: D2O;
ferrocene
102-54-5

ferrocene

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

ferrocene-d10

ferrocene-d10

Conditions
ConditionsYield
In 1,4-dioxane 3 fold 3 h heating of Fe(C5H5)2 with 10 fold excess of (2)H3PO4 in abs. dioxane at 110-120°C;; 98.1 % deuterated Fe(C5H5)2;;
potassium deuterohydroxide

potassium deuterohydroxide

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

deuterated potassium dihydrogen phosphate
13761-79-0

deuterated potassium dihydrogen phosphate

disodium tetracarbonylosmate

disodium tetracarbonylosmate

[D3]phosphoric acid
14335-33-2

[D3]phosphoric acid

(2)H2Os(CO)4

(2)H2Os(CO)4

Conditions
ConditionsYield
In further solvent(s) high-vacuum line;

Phosphoric acid-d3 Chemical Properties

Molecule structure of Phosphoric acid-d3 (CAS NO.14335-33-2):

IUPAC Name: Trideuterio phosphate 
Molecular Weight: 101.013666 g/mol
Molecular Formula: H3O4
Density: 1.741 g/mL at 25 °C
Melting Point: 41-44 °C(lit.)
Boiling Point: 158 °C at 760 mmHg
Index of Refraction: 1.51
Molar Refractivity: 13.52 cm3
Molar Volume: 45.2 cm3
Surface Tension: 136.3 dyne/cm
Vapour Pressure: 1.41 mmHg at 25 °C
XLogP3-AA: -2.1
H-Bond Donor: 3
H-Bond Acceptor: 4
Exact Mass: 100.995725
MonoIsotopic Mass: 100.995725
Topological Polar Surface Area: 77.8
Heavy Atom Count: 5
Canonical SMILES: OP(=O)(O)O
Isomeric SMILES: [2H]OP(=O)(O[2H])O[2H]
InChI: InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/i/hD3
InChIKey: NBIIXXVUZAFLBC-ZRLBSURWSA-N
EINECS: 238-285-0

Phosphoric acid-d3 Uses

 Phosphoric acid-d3 (CAS NO.14335-33-2) is used as NMR analysis.

Phosphoric acid-d3 Safety Profile

Hazard Codes: CorrosiveC
Risk Statements: 34 
R34:Causes burns.
Safety Statements: 26-36/37/39-45 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection. 
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR: UN 1805 8/PG 3
WGK Germany: 3
F: 10

Phosphoric acid-d3 Specification

 Phosphoric acid-d3 (CAS NO.14335-33-2) is also named (3H)Phosphoric acid ; Phosphoric acid-d3 solution ; Phosphoric Acid-d3 (85% in D2O) ; Trideuterophosphoric acid . Phosphoric acid-d3 (CAS NO.14335-33-2) is clear colorless solution.

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