C376H272 — CID 158076694
9,10-bis[4-(2,2-diphenylethenyl)-3-phenylphenyl]anthracene;9,10-bis[2-phenyl-3-(2-phenylethenyl)phenyl]anthracene;9,10-bis[2-phenyl-4-(2-phenylethenyl)phenyl]anthracene;9,10-bis[3-phenyl-5-(2-phenylethenyl)phenyl]anthracene;2-tert-butyl-9,10-bis[3-(2,2-diphenylethenyl)-5-naphthalen-2-ylphenyl]anthracene;2-tert-butyl-9,10-bis[3-(2,2-diphenylethenyl)-5-phenylphenyl]anthracene (PubChem CID 158076694) has the molecular formula C376H272 and a molecular weight of 4790.31 g/mol. Its IUPAC name is 9,10-bis[4-(2,2-diphenylethenyl)-3-phenylphenyl]anthracene;9,10-bis[2-phenyl-3-(2-phenylethenyl)phenyl]anthracene;9,10-bis[2-phenyl-4-(2-phenylethenyl)phenyl]anthracene;9,10-bis[3-phenyl-5-(2-phenylethenyl)phenyl]anthracene;2-tert-butyl-9,10-bis[3-(2,2-diphenylethenyl)-5-naphthalen-2-ylphenyl]anthracene;2-tert-butyl-9,10-bis[3-(2,2-diphenylethenyl)-5-phenylphenyl]anthracene.
| Compound Name | 9,10-bis[4-(2,2-diphenylethenyl)-3-phenylphenyl]anthracene;9,10-bis[2-phenyl-3-(2-phenylethenyl)phenyl]anthracene;9,10-bis[2-phenyl-4-(2-phenylethenyl)phenyl]anthracene;9,10-bis[3-phenyl-5-(2-phenylethenyl)phenyl]anthracene;2-tert-butyl-9,10-bis[3-(2,2-diphenylethenyl)-5-naphthalen-2-ylphenyl]anthracene;2-tert-butyl-9,10-bis[3-(2,2-diphenylethenyl)-5-phenylphenyl]anthracene |
|---|---|
| PubChem CID | 158076694 |
| Molecular Formula | C376H272 |
| Molecular Weight | 4790.31 g/mol |
| Exact Mass | 4786.13 |
| IUPAC Name | 9,10-bis[4-(2,2-diphenylethenyl)-3-phenylphenyl]anthracene;9,10-bis[2-phenyl-3-(2-phenylethenyl)phenyl]anthracene;9,10-bis[2-phenyl-4-(2-phenylethenyl)phenyl]anthracene;9,10-bis[3-phenyl-5-(2-phenylethenyl)phenyl]anthracene;2-tert-butyl-9,10-bis[3-(2,2-diphenylethenyl)-5-naphthalen-2-ylphenyl]anthracene;2-tert-butyl-9,10-bis[3-(2,2-diphenylethenyl)-5-phenylphenyl]anthracene |
| SMILES | C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2c3ccccc3c(-c3ccc(C=C(c4ccccc4)c4ccccc4)c(-c4ccccc4)c3)c3ccccc23)cc1-c1ccccc1.C(=Cc1cc(-c2ccccc2)cc(-c2c3ccccc3c(-c3cc(C=Cc4ccccc4)cc(-c4ccccc4)c3)c3ccccc23)c1)c1ccccc1.C(=Cc1ccc(-c2c3ccccc3c(-c3ccc(C=Cc4ccccc4)cc3-c3ccccc3)c3ccccc23)c(-c2ccccc2)c1)c1ccccc1.C(=Cc1cccc(-c2c3ccccc3c(-c3cccc(C=Cc4ccccc4)c3-c3ccccc3)c3ccccc23)c1-c1ccccc1)c1ccccc1.CC(C)(C)c1ccc2c(-c3cc(C=C(c4ccccc4)c4ccccc4)cc(-c4ccc5ccccc5c4)c3)c3ccccc3c(-c3cc(C=C(c4ccccc4)c4ccccc4)cc(-c4ccc5ccccc5c4)c3)c2c1.CC(C)(C)c1ccc2c(-c3cc(C=C(c4ccccc4)c4ccccc4)cc(-c4ccccc4)c3)c3ccccc3c(-c3cc(C=C(c4ccccc4)c4ccccc4)cc(-c4ccccc4)c3)c2c1 |
| InChI | InChI=1S/C78H58.C70H54.C66H46.3C54H38/c1-78(2,3)69-40-41-72-75(52-69)77(68-45-54(43-66(51-68)64-39-37-56-23-17-19-33-62(56)49-64)47-74(59-28-12-6-13-29-59)60-30-14-7-15-31-60)71-35-21-20-34-70(71)76(72)67-44-53(42-65(50-67)63-38-36-55-22-16-18-32-61(55)48-63)46-73(57-24-8-4-9-25-57)58-26-10-5-11-27-58;1-70(2,3)61-38-39-64-67(48-61)69(60-43-50(41-58(47-60)52-26-12-5-13-27-52)45-66(55-32-18-8-19-33-55)56-34-20-9-21-35-56)63-37-23-22-36-62(63)68(64)59-42-49(40-57(46-59)51-24-10-4-11-25-51)44-65(53-28-14-6-15-29-53)54-30-16-7-17-31-54;1-7-23-47(24-8-1)61(48-25-9-2-10-26-48)43-53-39-41-55(45-63(53)51-31-15-5-16-32-51)65-57-35-19-21-37-59(57)66(60-38-22-20-36-58(60)65)56-42-40-54(64(46-56)52-33-17-6-18-34-52)44-62(49-27-11-3-12-28-49)50-29-13-4-14-30-50;1-5-19-39(20-6-1)35-37-43-27-17-33-49(51(43)41-23-9-3-10-24-41)53-45-29-13-15-31-47(45)54(48-32-16-14-30-46(48)53)50-34-18-28-44(38-36-40-21-7-2-8-22-40)52(50)42-25-11-4-12-26-42;1-5-17-39(18-6-1)29-31-41-33-45(43-21-9-3-10-22-43)37-47(35-41)53-49-25-13-15-27-51(49)54(52-28-16-14-26-50(52)53)48-36-42(32-30-40-19-7-2-8-20-40)34-46(38-48)44-23-11-4-12-24-44;1-5-17-39(18-6-1)29-31-41-33-35-49(51(37-41)43-21-9-3-10-22-43)53-45-25-13-15-27-47(45)54(48-28-16-14-26-46(48)53)50-36-34-42(32-30-40-19-7-2-8-20-40)38-52(50)44-23-11-4-12-24-44/h4-52H,1-3H3;4-48H,1-3H3;1-46H;3*1-38H |
| InChIKey | FMLPAZFJEPOSRQ-UHFFFAOYSA-N |
| XLogP | 103.42 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 54 |
| Heavy Atoms | 376 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4790.31 |
| LogP ≤ 5 | 103.42 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |