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Name |
Dodecyl (Z,Z)-6,6-dioctyl-4,8,11-trioxo-5,7,12-trioxa-6-stannatetracosa-2,9-dienoate |
EINECS | N/A |
CAS No. | 7324-77-8 | Density | g/cm3 |
PSA | 105.20000 | LogP | 14.27660 |
Solubility | N/A | Melting Point |
N/A |
Formula | C48H88O8Sn | Boiling Point | 404.7°Cat760mmHg |
Molecular Weight | 912.05 | Flash Point | 137.6°C |
Transport Information | N/A | Appearance | N/A |
Safety | A severe eye irritant. When heated to decomposition it emits toxic vapors of Sn. | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | A severe eye irritant. | |
Synonyms |
EINECS 230-798-8; |
Molecule structure of Dodecyl (Z,Z)-6,6-dioctyl-4,8,11-trioxo-5,7,12-trioxa-6-stannatetracosa-2,9-dienoate (CAS NO.7324-77-8):
IUPAC Name of Dodecyl (Z,Z)-6,6-dioctyl-4,8,11-trioxo-5,7,12-trioxa-6-stannatetracosa-2,9-dienoate (CAS NO.7324-77-8): 1-O-[[(Z)-4-Dodecoxy-4-oxobut-2-enoyl]oxy-dioctylstannyl] 4-O-dodecyl(Z)-but-2-enedioate
Molecular Weight: 911.91752 g/mol
Molecular Formula: C48H88O8Sn
Boiling Point: 779 °C at 760 mmHg
Flash Point: 424.9 °C
Enthalpy of Vaporization: 113.37 kJ/mol
Vapour Pressure: 3.26E-24 mmHg at 25 °C
H-Bond Acceptor: 8
Rotatable Bond Count: 46
Exact Mass: 912.550116
MonoIsotopic Mass: 912.550116
Topological Polar Surface Area: 105
Heavy Atom Count: 57
Complexity: 946
Canonical SMILES: CCCCCCCCCCCCOC(=O)C=CC(=O)O[Sn](CCCCCCCC)(CCCCCCCC)OC(=O)C=CC(=O)
OCCCCCCCCCCCC
Isomeric SMILES: CCCCCCCCCCCCOC(=O)/C=C\C(=O)O[Sn](OC(=O)/C=C\C(=O)OCCCCCCCCCCCC)(CCCCCCCC)CCCCCCCC
InChI: InChI=1S/2C16H28O4.2C8H17.Sn/c2*1-2-3-4-5-6-7-8-9-10-11-14-20-16(19)13-12-15(17)18;2*1-3-5-7-8-6-4-2;/h2*12-13H,2-11,14H2,1H3,(H,17,18);2*1,3-8H2,2H3;/q;;;;+2/p-2/b2*13-12-;;;
InChIKey: OWDPVSGEPJRRNV-NUJFUEHTSA-L
EINECS of Dodecyl (Z,Z)-6,6-dioctyl-4,8,11-trioxo-5,7,12-trioxa-6-stannatetracosa-2,9-dienoate (CAS NO.7324-77-8): 230-798-8
1. | eye-rbt 100 mg/24H SEV | NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) OTS0571949 . |
A severe eye irritant. When heated to decomposition it emits toxic vapors of Sn.