C160H112N10 — CID 165101963
3-carbazol-9-yl-9-[3-(4-carbazol-9-ylcarbazol-9-yl)phenyl]carbazole;4-carbazol-9-yl-9-[3-(4-carbazol-9-ylcarbazol-9-yl)phenyl]carbazole;4-carbazol-9-yl-9-[3-[3-(9H-fluoren-9-yl)phenyl]phenyl]carbazole;methane (PubChem CID 165101963) has the molecular formula C160H112N10 and a molecular weight of 2174.73 g/mol. Its IUPAC name is 3-carbazol-9-yl-9-[3-(4-carbazol-9-ylcarbazol-9-yl)phenyl]carbazole;4-carbazol-9-yl-9-[3-(4-carbazol-9-ylcarbazol-9-yl)phenyl]carbazole;4-carbazol-9-yl-9-[3-[3-(9H-fluoren-9-yl)phenyl]phenyl]carbazole;methane.
| Compound Name | 3-carbazol-9-yl-9-[3-(4-carbazol-9-ylcarbazol-9-yl)phenyl]carbazole;4-carbazol-9-yl-9-[3-(4-carbazol-9-ylcarbazol-9-yl)phenyl]carbazole;4-carbazol-9-yl-9-[3-[3-(9H-fluoren-9-yl)phenyl]phenyl]carbazole;methane |
|---|---|
| PubChem CID | 165101963 |
| Molecular Formula | C160H112N10 |
| Molecular Weight | 2174.73 g/mol |
| Exact Mass | 2172.91 |
| IUPAC Name | 3-carbazol-9-yl-9-[3-(4-carbazol-9-ylcarbazol-9-yl)phenyl]carbazole;4-carbazol-9-yl-9-[3-(4-carbazol-9-ylcarbazol-9-yl)phenyl]carbazole;4-carbazol-9-yl-9-[3-[3-(9H-fluoren-9-yl)phenyl]phenyl]carbazole;methane |
| SMILES | C.C.C.c1cc(-c2cccc(-n3c4ccccc4c4c(-n5c6ccccc6c6ccccc65)cccc43)c2)cc(C2c3ccccc3-c3ccccc32)c1.c1cc(-n2c3ccccc3c3c(-n4c5ccccc5c5ccccc54)cccc32)cc(-n2c3ccccc3c3c(-n4c5ccccc5c5ccccc54)cccc32)c1.c1cc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)cc(-n2c3ccccc3c3c(-n4c5ccccc5c5ccccc54)cccc32)c1 |
| InChI | InChI=1S/2C54H34N4.C49H32N2.3CH4/c1-7-23-45-38(17-1)39-18-2-8-24-46(39)56(45)37-31-32-51-44(34-37)42-21-5-9-25-47(42)55(51)35-15-13-16-36(33-35)57-50-28-12-6-22-43(50)54-52(57)29-14-30-53(54)58-48-26-10-3-19-40(48)41-20-4-11-27-49(41)58;1-7-24-43-37(18-1)38-19-2-8-25-44(38)57(43)51-32-14-30-49-53(51)41-22-5-11-28-47(41)55(49)35-16-13-17-36(34-35)56-48-29-12-6-23-42(48)54-50(56)31-15-33-52(54)58-45-26-9-3-20-39(45)40-21-4-10-27-46(40)58;1-3-22-40-36(18-1)37-19-2-4-23-41(37)48(40)34-16-11-14-32(30-34)33-15-12-17-35(31-33)50-45-27-10-7-24-42(45)49-46(50)28-13-29-47(49)51-43-25-8-5-20-38(43)39-21-6-9-26-44(39)51;;;/h2*1-34H;1-31,48H;3*1H4 |
| InChIKey | YMFCRTSBNANVMM-UHFFFAOYSA-N |
| XLogP | 42.77 |
| TPSA | 49.30 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 170 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2174.73 |
| LogP ≤ 5 | 42.77 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 10 |