C96H242O30Si17 — CID 162044046
2-[[[[dimethyl-[[methyl-bis(2-prop-2-enoyloxyethoxy)silyl]methyl]silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-methyl-(2-prop-2-enoyloxyethoxy)silyl]oxyethyl prop-2-enoate;[[[[[[[dimethyl(2-methylprop-2-enoyloxymethyl)silyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-methylsilyl]methyl 2-methylprop-2-enoate;[[[[[dimethyl(prop-2-enoyloxymethoxy)silyl]methyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxymethyl prop-2-enoate;methane (PubChem CID 162044046) has the molecular formula C96H242O30Si17 and a molecular weight of 2354.42 g/mol. Its IUPAC name is 2-[[[[dimethyl-[[methyl-bis(2-prop-2-enoyloxyethoxy)silyl]methyl]silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-methyl-(2-prop-2-enoyloxyethoxy)silyl]oxyethyl prop-2-enoate;[[[[[[[dimethyl(2-methylprop-2-enoyloxymethyl)silyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-methylsilyl]methyl 2-methylprop-2-enoate;[[[[[dimethyl(prop-2-enoyloxymethoxy)silyl]methyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxymethyl prop-2-enoate;methane.
| Compound Name | 2-[[[[dimethyl-[[methyl-bis(2-prop-2-enoyloxyethoxy)silyl]methyl]silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-methyl-(2-prop-2-enoyloxyethoxy)silyl]oxyethyl prop-2-enoate;[[[[[[[dimethyl(2-methylprop-2-enoyloxymethyl)silyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-methylsilyl]methyl 2-methylprop-2-enoate;[[[[[dimethyl(prop-2-enoyloxymethoxy)silyl]methyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxymethyl prop-2-enoate;methane |
|---|---|
| PubChem CID | 162044046 |
| Molecular Formula | C96H242O30Si17 |
| Molecular Weight | 2354.42 g/mol |
| Exact Mass | 2351.35 |
| IUPAC Name | 2-[[[[dimethyl-[[methyl-bis(2-prop-2-enoyloxyethoxy)silyl]methyl]silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-methyl-(2-prop-2-enoyloxyethoxy)silyl]oxyethyl prop-2-enoate;[[[[[[[dimethyl(2-methylprop-2-enoyloxymethyl)silyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxy-methylsilyl]methyl 2-methylprop-2-enoate;[[[[[dimethyl(prop-2-enoyloxymethoxy)silyl]methyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]methyl-dimethylsilyl]oxymethyl prop-2-enoate;methane |
| SMILES | C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C=C(C)C(=O)OC[SiH](C)O[Si](C)(C)C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C[Si](C)(C)O[Si](C)(C)COC(=O)C(=C)C.C=CC(=O)OCCO[Si](C)(C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C[Si](C)(OCCOC(=O)C=C)OCCOC(=O)C=C)OCCOC(=O)C=C.C=CC(=O)OCO[Si](C)(C)C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C[Si](C)(C)OCOC(=O)C=C |
| InChI | InChI=1S/C30H56O14Si5.C25H58O8Si7.C20H44O8Si5.21CH4/c1-13-27(31)35-17-21-39-48(11,40-22-18-36-28(32)14-2)25-45(5,6)43-47(9,10)44-46(7,8)26-49(12,41-23-19-37-29(33)15-3)42-24-20-38-30(34)16-4;1-22(2)24(26)28-18-34(5)30-36(8,9)20-38(12,13)32-40(16,17)33-39(14,15)21-37(10,11)31-35(6,7)19-29-25(27)23(3)4;1-13-19(21)23-15-25-29(3,4)17-31(7,8)27-33(11,12)28-32(9,10)18-30(5,6)26-16-24-20(22)14-2;;;;;;;;;;;;;;;;;;;;;/h13-16H,1-4,17-26H2,5-12H3;34H,1,3,18-21H2,2,4-17H3;13-14H,1-2,15-18H2,3-12H3;21*1H4 |
| InChIKey | YXQSAYJMODJUBW-UHFFFAOYSA-N |
| XLogP | 29.25 |
| TPSA | 339.62 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 30 |
| Rotatable Bonds | 62 |
| Heavy Atoms | 143 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2354.42 |
| LogP ≤ 5 | 29.25 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 30 |
| Structural Alerts | {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'} |
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