Hexanoic acid,2-ethyl-, 1,1'-(dioctylstannylene) ester supplier

Name
bis[(2-ethyl-1-oxohexyl)oxy]dioctylstannane
EINECS 246-325-3
CAS No. 24577-34-2
Density 1.1[at 20℃]
Solubility 0.11ng/L at 25℃
Melting Point
Formula C₃₂H₆₄O₄Sn
Boiling Point 554.9 °C at 760 mmHg
Molecular Weight 631.55816
Flash Point 289.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Dioctyltinbis(2-ethylhexanoate) (6CI);Stannane, bis[(2-ethyl-1-oxohexyl)oxy]dioctyl-(9CI);Dioctyltin di(2-ethylhexanoate);
PSA 52.60000
LogP 10.66880

Hexanoic acid,2-ethyl-, 1,1'-(dioctylstannylene) ester Specification

The Hexanoic acid,2-ethyl-, 1,1'-(dioctylstannylene) ester is an organic compound with the formula C₃₂H₆₄O₄Sn. The IUPAC name of this chemical is [2-ethylhexanoyloxy(dioctyl)stannyl] 2-ethylhexanoate. With the CAS registry number 24577-34-2, it is also named as Bis[(2-ethylhexanoyl)oxy](dioctyl)stannane.

Physical properties about Hexanoic acid,2-ethyl-, 1,1'-(dioctylstannylene) ester are: (1)ACD/LogP: 17.07; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 17.07; (4)ACD/LogD (pH 7.4): 17.07; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 4; (10)#Freely Rotating Bonds: 28; (11)Polar Surface Area: 52.6 Å²; (12)Flash Point: 289.4 °C; (13)Enthalpy of Vaporization: 83.6 kJ/mol; (14)Boiling Point: 554.9 °C at 760 mmHg; (15)Vapour Pressure: 2.37E-12 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O[Sn](CCCCCCCC)(OC(=O)C(CC)CCCC)CCCCCCCC)C(CC)CCCC
(2)InChI: InChI=1/2C8H16O2.2C8H17.Sn/c2*1-3-5-6-7(4-2)8(9)10;2*1-3-5-7-8-6-4-2;/h2*7H,3-6H2,1-2H3,(H,9,10);2*1,3-8H2,2H3;/q;;;;+2/p-2/rC32H64O4Sn/c1-7-13-17-19-21-23-27-37(28-24-22-20-18-14-8-2,35-31(33)29(11-5)25-15-9-3)36-32(34)30(12-6)26-16-10-4/h29-30H,7-28H2,1-6H3
(3)InChIKey: QHZLCTYHMCNIMS-JWSWPSRXAP
(4)Std. InChI: InChI=1S/2C8H16O2.2C8H17.Sn/c2*1-3-5-6-7(4-2)8(9)10;2*1-3-5-7-8-6-4-2;/h2*7H,3-6H2,1-2H3,(H,9,10);2*1,3-8H2,2H3;/q;;;;+2/p-2
(5)Std. InChIKey: QHZLCTYHMCNIMS-UHFFFAOYSA-L

Product Name

bis[(2-ethyl-1-oxohexyl)oxy]dioctylstannane

Hexanoic acid,2-ethyl-, 1,1'-(dioctylstannylene) ester Specification

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