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Yttrium (III) nitrate hexahydrate (1:3:6)

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Yttrium (III) nitrate hexahydrate (1:3:6)

EINECS 233-802-6
CAS No. 13494-98-9 Density 2.682 g/mL at 25 °C(lit.)
PSA 262.02000 LogP 0.46650
Solubility Soluble in water. Melting Point 51.8°C
Formula YN3O9.6H2O Boiling Point 83 °C at 760 mmHg
Molecular Weight 274.921 Flash Point N/A
Transport Information UN 1477 5.1/PG 3 Appearance white adhering crystals or crystalline powder
Safety 17-26-36/37/39 Risk Codes 8-36/37/38
Molecular Structure Molecular Structure of 13494-98-9 (YTTRIUM NITRATE HEXAHYDRATE) Hazard Symbols IrritantXi; OxidizingO
Synonyms

Yttriumnitrate hexahydrate;Yttrium trinitrate hexahydrate;Yttrium(III) nitratehexahydrate;

Article Data 128

Yttrium (III) nitrate hexahydrate (1:3:6) Synthetic route

yttrium(III) oxide

7697-37-2

nitric acid

barium carbonate

copper(II) oxide

A

barium(II) nitrate

B

13494-98-9

yttrium(III) nitrate

C

copper(II) hydroxynitrate

Conditions
ConditionsYield
In water nitrates of Ba and Y and a basic nitrate of Cu obtained on treatment of CuO, BaCO3 and Y2O3 with HNO3; soln. evapd. to dryness; X-ray diffraction;

yttrium barium copper oxide

7697-37-2

nitric acid

A

barium(II) nitrate

B

13494-98-9

yttrium(III) nitrate

C

copper(II) nitrate

Conditions
ConditionsYield
In nitric acid byproducts: H2O; dissoln.;

yttrium(III) oxide

7697-37-2

nitric acid

13494-98-9

yttrium(III) nitrate

Conditions
ConditionsYield
Y2O3 dissolved in conc. HNO3;
In water Y2O3 dissolved in dil. HNO3 to pH 2;
In nitric acid Y2O3 dissolved in min. amt. dild. nitric acid (1:1), evapd. to dryness; cooled to room temp.;

yttrium(III) oxide

10544-72-6

dinitrogen tetraoxide

13494-98-9

yttrium(III) nitrate

Conditions
ConditionsYield
steel bomb, 150°C, 80 atm, 24 h;>99
In neat (no solvent) byproducts: N2O3; heating at 150°C, 80 atm;;

yttrium(III) nitrate hydrate

13494-98-9

yttrium(III) nitrate

Conditions
ConditionsYield
In neat (no solvent) heating (160-140°C), vac.;

yttrium(III) oxide

13494-98-9

yttrium(III) nitrate

Conditions
ConditionsYield
With nitric acid In water Dissolving the oxide into reagent grade conc. nitric acid.; Heating the soln. to remove excess HNO3.;
With HNO3 In nitric acid aq. HNO3; dissoln. of oxide in boiling nitric acid;

yttrium(III) oxide

10102-44-0

Nitrogen dioxide

13494-98-9

yttrium(III) nitrate

Conditions
ConditionsYield
In neat (no solvent) heating at 150°C in a closed tube for 24 hours;;>99

2NH4(1+)*Y(3+)*5(NO3)(1-)=(NH4)2Y(NO3)5

A

ammonium nitrate

B

13494-98-9

yttrium(III) nitrate

Conditions
ConditionsYield
In neat (no solvent) thermic decomposition on heating at 232°C (decomposition of NH4NO3 not above 270°C);; thermoanalysis;;
In neat (no solvent) thermic decomposition on heating at 232°C (decomposition of NH4NO3 not above 270°C);; thermoanalysis;;

yttrium(III) oxide

neodymium(III) oxide

7697-37-2

nitric acid

A

13494-98-9

yttrium(III) nitrate

B

16454-60-7

neodymium(III) nitrate

Conditions
ConditionsYield
Heating;

yttrium(lll) nitrate hexahydrate

13494-98-9

yttrium(III) nitrate

Conditions
ConditionsYield
With nitric acid Heating;

Yttrium (III) nitrate hexahydrate (1:3:6) Standards and Recommendations

ACGIH TLV: TWA 1 mg(Y)/m3

Yttrium (III) nitrate hexahydrate (1:3:6) Specification

The Yttrium Nitrate Hexahydrate, with the CAS registry number 13494-98-9 and EINECS registry number 233-802-6, has the systematic name of yttrium nitrate hydrate (1:3:6). It is a kind of white adhering crystals or crystalline powder, and belongs to the following product categories: Metal and Ceramic Science; Salts; Yttrium Salts. And the molecular formula of this chemical is YN3O9.6H2O. What's more, it should be stored at 0-6°C.

The physical properties of Yttrium Nitrate Hexahydrate are as followings: (1)ACD/LogP: -0.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.13; (4)ACD/LogD (pH 7.4): -0.13; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 0; (10)Polar Surface Area: 66.05 Å2; (11)Enthalpy of Vaporization: 37.72 kJ/mol; (12)Boiling Point: 83 °C at 760 mmHg; (13)Vapour Pressure: 49.8 mmHg at 25°C.

The preparation of Yttrium Nitrate Hexahydrate: Excessive Y2O3 react with hot concentrated nitric acid. After filtration, remove unreacted oxide, then by cooling crystallization, suction filtration and drying, you can get the product.

You can still convert the following datas into molecular structure:
(1)SMILES: [Y+3].O=[N+]([O-])[O-].[O-][N+]([O-])=O.[O-][N+]([O-])=O.O.O.O.O.O.O
(2)InChI: InChI=1/3NO3.6H2O.Y/c3*2-1(3)4;;;;;;;/h;;;6*1H2;/q3*-1;;;;;;;+3
(3)InChIKey: QBAZWXKSCUESGU-UHFFFAOYAY

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
frog LDLo subcutaneous 350mg/kg (350mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 141, Pg. 273, 1929.
mouse LDLo subcutaneous 16600mg/kg (16600mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 141, Pg. 273, 1929.

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