1-Propanol, zirconium(4+) salt (4:1) supplier

Name
ZIRCONIUM N-PROPOXIDE
EINECS 245-711-9
CAS No. 23519-77-9
Density 1.058 g/mL at 20 °C
Solubility insoluble in water
Melting Point
Formula C₁₂H₂₈O₄Zr
Boiling Point 95.8 °C at 760 mmHg
Molecular Weight 327.576
Flash Point 15 °C
Transport Information UN 1993
Appearance yellow-colored liquid
Safety 26-39
Risk Codes 10-41-67
Molecular Structure
Hazard Symbols Xi
Synonyms 1-Propanol,zirconium(4+) salt (9CI);Propyl alcohol, zirconium(4+) salt (8CI);Zirconiumpropoxide (6CI);Orgatix ZA 40;Propyl zirconate;Tetra-n-propoxyzirconium;Tetra-n-propyl zirconate;Tetrapropoxyzirconium;Tetrapropyl zirconate;Tetrapropyl zirconate (Zr(OC3H7)4);Tilcom NPZ;Tyzor NPZ;Vertec NPZ;Zirconicacid propyl ester;Zirconium n-propoxide;Zirconium propoxide (Zr(OPr)4);Zirconium tetrakis(1-propoxide);Zirconium tetrapropanolate;Zirconiumtetrapropoxide;Zirconium tetrapropylate;Zirconium(4+) propanolate;Zirconium(4+) propoxide;Zirconium(IV) n-propoxide;Zirconium(IV) propoxide;
PSA 36.92000
LogP 3.50920

1-Propanol, zirconium(4+) salt (4:1) Specification

The IUPAC name of 1-Propanol, zirconium(4+) salt (4:1) is propan-1-olate; zirconium(4+). With the CAS registry number 23519-77-9, it is also named as Zirconium tetrapropanolate. The product's category is Organometallics, and the other registry number is 104814-64-4. Besides, it is yellow-colored liquid with an alcohol-like odor which should be stored in closed container in a cooland dry place. And this chemical is incompatible with acids, bases and oxidizing agents. It also reacts with water to generate toxic or flammable gases. In addition, its molecular formula is C₁₂H₂₈O₄Zr and molecular weight is 327.57.

The other characteristics of this product can be summarized as: (1)EINECS: 245-711-9; (2)ACD/LogP: 0.34; (3)# of Rule of 5 Violations: 0; (4)ACD/LogD (pH 5.5): 0.34; (5)ACD/LogD (pH 7.4): 0.34; (6)ACD/BCF (pH 5.5): 1.07; (7)ACD/BCF (pH 7.4): 1.07; (8)ACD/KOC (pH 5.5): 36.65; (9)ACD/KOC (pH 7.4): 36.65; (10)H bond acceptors: 1; (11)H bond donors: 1; (12)Freely Rotating Bonds: 2; (13)Density: 1.058 g/mL at 20 °C; (14)Flash Point: 15 °C; (15)Enthalpy of Vaporization: 41.44 kJ/mol; (16)Boiling Point: 95.8 °C at 760 mmHg; (17)Vapour Pressure: 26.3 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following: 1-Propanol, zirconium(4+) salt (4:1) is flammable. And it is risk of serious damage to the eyes. You should wear eye / face protection when use it. Moreover, its vapours may cause drowsiness and dizziness. And in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

People can use the following data to convert to the molecule structure.
(1)SMILES:[Zr+4].[O-]CCC.[O-]CCC.[O-]CCC.[O-]CCC
(2)InChI:InChI=1/4C3H7O.Zr/c4*1-2-3-4;/h4*2-3H2,1H3;/q4*-1;+4
(3)InChIKey:XPGAWFIWCWKDDL-UHFFFAOYAL
(4)Std. InChI:InChI=1S/4C3H7O.Zr/c4*1-2-3-4;/h4*2-3H2,1H3;/q4*-1;+4
(5)Std. InChIKey:XPGAWFIWCWKDDL-UHFFFAOYSA-N

Product Name

ZIRCONIUM N-PROPOXIDE

1-Propanol, zirconium(4+) salt (4:1) Specification

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