Zinc dibenzoate supplier | CasNO.553-72-0

Name
ZINC BENZOATE
EINECS 209-047-3
CAS No. 553-72-0
Article Data15
CAS DataBase
Density 1.197g/cm3
Solubility 23.95g/L at 20℃
Melting Point
Formula C₁₄H₁₀O₄Zn
Boiling Point 249.3 °C at 760 mmHg
Molecular Weight 307.621
Flash Point 111.4 °C
Transport Information
Appearance White powder
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzoicacid, zinc salt (8CI,9CI);Zinc benzoate (6CI,7CI);Z 00160;Zinc benzoate;
PSA 37.30000
LogP 1.38230

Zinc dibenzoate Specification

The Benzoic acid, zinc salt(2:1), with the CAS registry number 553-72-0 and EINECS registry number 209-047-3, has the systematic name and IUPAC name of zinc dibenzoate. It belongs to the product category of Organic-metal salt. And the molecular formula of the chemical is C₁₄H₁₀O₄Zn. What's more, it can be prepared by Benzoic acid and Zinc oxide.

The characteristics of Benzoic acid, zinc salt(2:1) are as followings: (1)ACD/LogP: 1.90; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.58; (4)ACD/LogD (pH 7.4): -0.98; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 12.43; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 37.3 Å²; (13)Flash Point: 111.4 °C; (14)Enthalpy of Vaporization: 51.4 kJ/mol; (15)Boiling Point: 249.3 °C at 760 mmHg; (16)Vapour Pressure: 0.0122 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Zn+2].[O-]C(=O)c1ccccc1.[O-]C(=O)c1ccccc1
(2)InChI: InChI=1/2C7H6O2.Zn/c2*8-7(9)6-4-2-1-3-5-6;/h2*1-5H,(H,8,9);/q;;+2/p-2
(3)InChIKey: JDLYKQWJXAQNNS-NUQVWONBAC

Product Name

ZINC BENZOATE

Zinc dibenzoate Specification

Related Products

Hot Products