Heptanoic acid, zincsalt (2:1) supplier

Name
ZINC HEPTOATE
EINECS 226-069-9
CAS No. 5261-20-1
Article Data2
CAS DataBase
Density 1.24 g/cm3
Solubility
Melting Point 142.9 °C
Formula C₁₄H₂₆O₄Zn
Boiling Point 222.6 °C at 760 mmHg
Molecular Weight 323.748
Flash Point 99.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Heptanoicacid, zinc salt (8CI,9CI);Zinc heptanoate (7CI);Zinc enanthate;Diheptanoic acid zinc salt;
PSA 80.26000
LogP 1.41090

Heptanoic acid, zincsalt (2:1) Specification

The Heptanoic acid, zincsalt (2:1), with the CAS registry number 5261-20-1, is also known as Diheptanoic acid zinc salt. Its EINECS registry number is 226-069-9. This chemical's molecular formula is C₁₄H₂₆O₄Zn and molecular weight is 323.74. What's more, both its IUPAC name and systematic name are the same which is called Zinc diheptanoate.

Physical properties about Heptanoic acid, zincsalt (2:1) are: (1)ACD/LogP: 2.37; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.58; (4)ACD/LogD (pH 7.4): -0.22; (5)ACD/BCF (pH 5.5): 5.99; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 74.54; (8)ACD/KOC (pH 7.4): 1.2; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 37.3 Å²; (13)Flash Point: 99.2 °C; (14)Enthalpy of Vaporization: 48.52 kJ/mol; (15)Boiling Point: 222.6 °C at 760 mmHg; (16)Vapour Pressure: 0.0578 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: [Zn+2].[O-]C(=O)CCCCCC.[O-]C(=O)CCCCCC
(2)InChI: InChI=1/2C7H14O2.Zn/c2*1-2-3-4-5-6-7(8)9;/h2*2-6H2,1H3,(H,8,9);/q;;+2/p-2
(3)InChIKey: XWHCUISQLSVNCW-NUQVWONBAS

Product Name

ZINC HEPTOATE

Heptanoic acid, zincsalt (2:1) Specification

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