C305H210 — CID 157129330
9,10-bis(9,9-dimethylfluoren-2-yl)-2-(10-naphthalen-2-ylanthracen-9-yl)anthracene;9,10-bis(9,9-dimethylfluoren-2-yl)-2-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;2-(9,9-dimethylfluoren-2-yl)-9,10-bis(4-phenylphenyl)anthracene;2-(10-naphthalen-2-ylanthracen-9-yl)-9,10-bis(4-phenylphenyl)anthracene;2-phenanthren-9-yl-9,10-bis(4-phenylphenyl)anthracene (PubChem CID 157129330) has the molecular formula C305H210 and a molecular weight of 3875.03 g/mol. Its IUPAC name is 9,10-bis(9,9-dimethylfluoren-2-yl)-2-(10-naphthalen-2-ylanthracen-9-yl)anthracene;9,10-bis(9,9-dimethylfluoren-2-yl)-2-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;2-(9,9-dimethylfluoren-2-yl)-9,10-bis(4-phenylphenyl)anthracene;2-(10-naphthalen-2-ylanthracen-9-yl)-9,10-bis(4-phenylphenyl)anthracene;2-phenanthren-9-yl-9,10-bis(4-phenylphenyl)anthracene.
| Compound Name | 9,10-bis(9,9-dimethylfluoren-2-yl)-2-(10-naphthalen-2-ylanthracen-9-yl)anthracene;9,10-bis(9,9-dimethylfluoren-2-yl)-2-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;2-(9,9-dimethylfluoren-2-yl)-9,10-bis(4-phenylphenyl)anthracene;2-(10-naphthalen-2-ylanthracen-9-yl)-9,10-bis(4-phenylphenyl)anthracene;2-phenanthren-9-yl-9,10-bis(4-phenylphenyl)anthracene |
|---|---|
| PubChem CID | 157129330 |
| Molecular Formula | C305H210 |
| Molecular Weight | 3875.03 g/mol |
| Exact Mass | 3871.64 |
| IUPAC Name | 9,10-bis(9,9-dimethylfluoren-2-yl)-2-(10-naphthalen-2-ylanthracen-9-yl)anthracene;9,10-bis(9,9-dimethylfluoren-2-yl)-2-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;2-(9,9-dimethylfluoren-2-yl)-9,10-bis(4-phenylphenyl)anthracene;2-(10-naphthalen-2-ylanthracen-9-yl)-9,10-bis(4-phenylphenyl)anthracene;2-phenanthren-9-yl-9,10-bis(4-phenylphenyl)anthracene |
| SMILES | CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4cc(-c5c6ccccc6c(-c6ccc(-c7ccccc7)cc6)c6ccccc56)ccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4cc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6ccccc56)ccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(-c5ccc(-c6ccccc6)cc5)c5ccccc5c(-c5ccc(-c6ccccc6)cc5)c4c3)cc21.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccccc5)cc4)c4cc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6ccccc56)ccc34)cc2)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccccc5)cc4)c4cc(-c5cc6ccccc6c6ccccc56)ccc34)cc2)cc1 |
| InChI | InChI=1S/C70H50.C68H48.C62H40.C53H38.C52H34/c1-69(2)61-28-16-14-20-49(61)51-37-34-47(41-63(51)69)67-57-26-12-13-27-58(57)68(48-35-38-52-50-21-15-17-29-62(50)70(3,4)64(52)42-48)60-40-46(36-39-59(60)67)66-55-24-10-8-22-53(55)65(54-23-9-11-25-56(54)66)45-32-30-44(31-33-45)43-18-6-5-7-19-43;1-67(2)59-27-15-13-19-47(59)49-34-31-45(39-61(49)67)65-55-25-11-12-26-56(55)66(46-32-35-50-48-20-14-16-28-60(48)68(3,4)62(50)40-46)58-38-44(33-36-57(58)65)64-53-23-9-7-21-51(53)63(52-22-8-10-24-54(52)64)43-30-29-41-17-5-6-18-42(41)37-43;1-3-15-41(16-4-1)44-27-32-46(33-28-44)59-51-21-9-10-22-52(51)60(47-34-29-45(30-35-47)42-17-5-2-6-18-42)58-40-50(37-38-57(58)59)62-55-25-13-11-23-53(55)61(54-24-12-14-26-56(54)62)49-36-31-43-19-7-8-20-48(43)39-49;1-53(2)49-20-12-11-17-43(49)44-31-29-42(34-50(44)53)41-30-32-47-48(33-41)52(40-27-23-38(24-28-40)36-15-7-4-8-16-36)46-19-10-9-18-45(46)51(47)39-25-21-37(22-26-39)35-13-5-3-6-14-35;1-3-13-35(14-4-1)37-23-27-39(28-24-37)51-46-21-11-12-22-47(46)52(40-29-25-38(26-30-40)36-15-5-2-6-16-36)50-34-42(31-32-48(50)51)49-33-41-17-7-8-18-43(41)44-19-9-10-20-45(44)49/h5-42H,1-4H3;5-40H,1-4H3;1-40H;3-34H,1-2H3;1-34H |
| InChIKey | AIWKNJAEMSCMND-UHFFFAOYSA-N |
| XLogP | 84.70 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 25 |
| Heavy Atoms | 305 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3875.03 |
| LogP ≤ 5 | 84.70 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |