10-Oxa-4,6-dithia-5-stannaeicosanoicacid, 5,5-didodecyl-9-oxo-, decyl ester supplier

Name
decyl 5,5-didodecyl-9-oxo-10-oxa-4,6-dithia-5-stannaicosanoate
EINECS 281-002-0
CAS No. 83833-27-6
Density
Solubility
Melting Point
Formula C₅₀H₁₀₀O₄S₂Sn
Boiling Point 816.4 °C at 760 mmHg
Molecular Weight 948.17
Flash Point 447.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Decyl 5,5-didodecyl-9-oxo-10-oxa-4,6-dithia-5-stannaicosanoate;Decyl 3-[(3-decoxy-3-oxo-propyl)sulfanyl-didodecyl-stannyl]sulfanylpropanoate;
PSA 103.20000
LogP 17.88480

10-Oxa-4,6-dithia-5-stannaeicosanoicacid, 5,5-didodecyl-9-oxo-, decyl ester Specification

The 10-Oxa-4,6-dithia-5-stannaeicosanoicacid, 5,5-didodecyl-9-oxo-, decyl ester, with the CAS registry number 83833-27-6, is also known as Decyl 5,5-didodecyl-9-oxo-10-oxa-4,6-dithia-5-stannaicosanoate. Its EINECS number is 281-002-0. This chemical's molecular formula is C₅₀H₁₀₀O₄S₂Sn and molecular weight is 948.17. What's more, its IUPAC name is decyl 3-[(3-decoxy-3-oxopropyl)sulfanyl-didodecylstannyl]sulfanylpropanoate.

Physical properties of 10-Oxa-4,6-dithia-5-stannaeicosanoicacid, 5,5-didodecyl-9-oxo-, decyl ester are: (1)ACD/LogP: 27.34; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 27.34; (4)ACD/LogD (pH 7.4): 27.34; (5)#H bond acceptors: 4; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 50; (8)Polar Surface Area: 103.2 Å²; (9)Flash Point: 447.6 °C; (10)Enthalpy of Vaporization: 118.67 kJ/mol; (11)Boiling Point: 816.4 °C at 760 mmHg; (12)Vapour Pressure: 9.67E-27 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCCCCCCCCC[Sn](CCCCCCCCCCCC)(SCCC(=O)OCCCCCCCCCC)SCCC(=O)OCCCCCCCCCC
(2)InChI: InChI=1S/2C13H26O2S.2C12H25.Sn/c2*1-2-3-4-5-6-7-8-9-11-15-13(14)10-12-16;2*1-3-5-7-9-11-12-10-8-6-4-2;/h2*16H,2-12H2,1H3;2*1,3-12H2,2H3;/q;;;;+2/p-2
(3)InChIKey: OGYQJYUEGRTCLN-UHFFFAOYSA-L

Product Name

decyl 5,5-didodecyl-9-oxo-10-oxa-4,6-dithia-5-stannaicosanoate

10-Oxa-4,6-dithia-5-stannaeicosanoicacid, 5,5-didodecyl-9-oxo-, decyl ester Specification

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