C60H48N2Si2 — CID 146775292
7-N',17-N'-diphenyl-7-N'-(3-silylphenyl)-17-N'-(3-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-7',17'-diamine (PubChem CID 146775292) has the molecular formula C60H48N2Si2 and a molecular weight of 853.23 g/mol. Its IUPAC name is 7-N',17-N'-diphenyl-7-N'-(3-silylphenyl)-17-N'-(3-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-7',17'-diamine.
| Compound Name | 7-N',17-N'-diphenyl-7-N'-(3-silylphenyl)-17-N'-(3-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-7',17'-diamine |
|---|---|
| PubChem CID | 146775292 |
| Molecular Formula | C60H48N2Si2 |
| Molecular Weight | 853.23 g/mol |
| Exact Mass | 852.34 |
| IUPAC Name | 7-N',17-N'-diphenyl-7-N'-(3-silylphenyl)-17-N'-(3-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-7',17'-diamine |
| SMILES | C[Si](C)(C)c1cccc(N(c2ccccc2)c2ccc3cc4c(cc3c2)C2(c3ccccc3-c3ccccc32)c2cc3cc(N(c5ccccc5)c5cccc([SiH3])c5)ccc3cc2-4)c1 |
| InChI | InChI=1S/C60H48N2Si2/c1-64(2,3)51-23-15-21-47(39-51)62(45-18-8-5-9-19-45)49-31-29-41-35-55-54-34-40-28-30-48(61(44-16-6-4-7-17-44)46-20-14-22-50(63)38-46)32-42(40)36-58(54)60(59(55)37-43(41)33-49)56-26-12-10-24-52(56)53-25-11-13-27-57(53)60/h4-39H,1-3,63H3 |
| InChIKey | RSPJLVRJVXOQPY-UHFFFAOYSA-N |
| XLogP | 13.81 |
| TPSA | 6.48 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 64 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 853.23 |
| LogP ≤ 5 | 13.81 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|