Basic information
- Name:
Zirconium, bis(nitrato-kO)oxo-
- Superlist Name:
- Zirconyl nitrate
- CAS No.:
13826-66-9
- Molecular Structure:
- Formula:
- N2O7Zr
- Molecular Weight:
- 231.24
- Deleted CAS:
- 12337-16-5,13862-18-5,252209-76-0
- Synonyms:
- Zirconium,bis(nitrato-O)oxo-;Zirconium, dinitratooxo- (8CI);Zirconyl nitrate (6CI,7CI);Bis(nitrato)oxozirconium;Bis(nitrato-kO)oxozirconium;Dinitratooxozirconium;NSC 148480;Zirconium dinitrate oxide;Zirconium nitrate oxide (ZrO(NO3)2);Zirconium oxidedinitrate;Zirconium oxide nitrate (ZrO(NO3)2);Zirconium oxynitrate;Zirconiumoxynitrate (ZrO(NO3)2);Zirconyl dinitrate;Zirconyl nitrate (ZrO(NO3)2);Zircosol ZN;
- EINECS:
- 237-529-3
- Boiling Point:
- 83 °C at 760 mmHg
- Solubility:
- Soluble in water
- Hazard Symbols:
O, 
C- Risk Codes:
- 8-34
- Safety Description:
- 17-26-36/37/39-45 Details
- Transport Information:
- UN 3098 5.1/PG 2
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Consensus Reports
Standards and Recommendations
ACGIH TLV: TWA 5 mg(Zr)/m3; STEL 10 mg(Zr)/m3
DFG MAK: 1 mg(Zr)/m3
Specification
The Zirconium, bis(nitrato-kO)oxo-, with the CAS registry number 13826-66-9 and EINECS registry number 237-529-3, has the systematic name of oxozirconium - nitric acid (1:2). It belongs to the following product categories: Inorganics; Metal and Ceramic Science; Salts; Zirconium Salts. And the molecular formula of this chemical is N2O7Zr. What's more, it is always used for the determination of potassium or fluoride.
The physical properties of Zirconium, bis(nitrato-kO)oxo- 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: 55.05 Å2.
You should be cautious while dealing with this chemical. If contact with combustible material, and may cause fire. And this chemical may cause burns. Therefore, you had better take the following instructions: Keep away from combustible material; Wear suitable protective clothing, gloves and eye/face protection, and in case of contact with eyes, rinse immediately with plenty of water and seek medical advice; In case of accident or if you feel unwell, seek medical advice immediately (show label where possible).
You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])O.[O-][N+](=O)O.O=[Zr]
(2)InChI: InChI=1/2HNO3.O.Zr/c2*2-1(3)4;;/h2*(H,2,3,4);;/r2HNO3.OZr/c2*2-1(3)4;1-2/h2*(H,2,3,4);
(3)InChIKey: UJVRJBAUJYZFIX-XSAJKTQWAD
The toxicity data is as follows:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rat | LD50 | intraperitoneal | 1250mg/kg (1250mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) | Archives of Industrial Hygiene and Occupational Medicine. Vol. 1, Pg. 637, 1950. |
| rat | LD50 | oral | 2500mg/kg (2500mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) | Archives of Industrial Hygiene and Occupational Medicine. Vol. 1, Pg. 637, 1950. |