9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole

C76H56N2 — CID 59236047

IUPAC9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole
SMILESCC1(C)c2cc(/C=C(\c3ccccc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc2-c2cc3c(cc21)-c1ccc(/C=C(\c2ccccc2)c2ccc4c(c2)c2ccccc2n4-c2ccccc2)cc1C3(C)C
InChIInChI=1S/C76H56N2/c1-75(2)67-43-49(41-61(51-21-9-5-10-22-51)53-35-39-73-65(45-53)59-29-17-19-31-71(59)77(73)55-25-13-7-14-26-55)33-37-57(67)63-48-70-64(47-69(63)75)58-38-34-50(44-68(58)76(70,3)4)42-62(52-23-11-6-12-24-52)54-36-40-74-66(46-54)60-30-18-20-32-72(60)78(74)56-27-15-8-16-28-56/h5-48H,1-4H3/b61-41+,62-42+
InChIKeyMINGCZNNUHHBOU-VOGGQTKHSA-N
MW997.30 g/mol
LogP19.67
Rot. Bonds8

About 9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole

9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole (PubChem CID 59236047) has the molecular formula C76H56N2 and a molecular weight of 997.30 g/mol. Its IUPAC name is 9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole.

Molecular Properties

Compound Name9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole
PubChem CID59236047
Molecular FormulaC76H56N2
Molecular Weight997.30 g/mol
Exact Mass996.44
IUPAC Name9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole
SMILESCC1(C)c2cc(/C=C(\c3ccccc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc2-c2cc3c(cc21)-c1ccc(/C=C(\c2ccccc2)c2ccc4c(c2)c2ccccc2n4-c2ccccc2)cc1C3(C)C
InChIInChI=1S/C76H56N2/c1-75(2)67-43-49(41-61(51-21-9-5-10-22-51)53-35-39-73-65(45-53)59-29-17-19-31-71(59)77(73)55-25-13-7-14-26-55)33-37-57(67)63-48-70-64(47-69(63)75)58-38-34-50(44-68(58)76(70,3)4)42-62(52-23-11-6-12-24-52)54-36-40-74-66(46-54)60-30-18-20-32-72(60)78(74)56-27-15-8-16-28-56/h5-48H,1-4H3/b61-41+,62-42+
InChIKeyMINGCZNNUHHBOU-VOGGQTKHSA-N
XLogP19.67
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms78
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500997.30
LogP ≤ 519.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole with MolForge

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Related Compounds

3-[4-[(E)-2-[4-[9,9-dimethyl-7-(7,9,9-trimethylfluoren-2-yl)fluoren-2-yl]phenyl]-1-phenylethenyl]phenyl]-9-phenylcarbazole
CID 59236111
9-[4-[2-(9,9-dimethylfluoren-3-yl)-2-[4-(3,5-diphenylphenyl)phenyl]ethenyl]phenyl]carbazole
CID 144810532
9-phenyl-3-[(E)-2-[4-[6,6,12,12-tetramethyl-2-[4-[(E)-2-(9-phenylcarbazol-3-yl)ethenyl]phenyl]indeno[1,2-b]fluoren-8-yl]phenyl]ethenyl]carbazole
CID 59236371
3-[4-[9,9-dimethyl-7-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]fluoren-2-yl]naphthalen-1-yl]-9-phenylcarbazole
CID 59236172
3-[(E)-2-[4-[7-[9,9-dimethyl-7-[4-[(E)-2-(9-phenylcarbazol-3-yl)ethenyl]phenyl]fluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]ethenyl]-9-phenylcarbazole
CID 59236662
11,11-dimethyl-5-phenylindeno[1,2-b]carbazole
CID 58059223
9,11,11-trimethyl-5-phenylindeno[1,2-b]carbazole
CID 71250183
3-[4-[(E)-2-[7-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]-9-phenylcarbazole
CID 59236659
2-carbazol-9-yl-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole
CID 139504500
3-[6-[9,9-dimethyl-7-[6-(9-phenylcarbazol-3-yl)naphthalen-2-yl]fluoren-2-yl]naphthalen-2-yl]-9-phenylcarbazole
CID 59236707
9-[4-[2-[4-[4-[2,2-bis(4-carbazol-9-ylphenyl)ethenyl]phenyl]phenyl]-1-(4-carbazol-9-ylphenyl)ethenyl]phenyl]carbazole
CID 102262971
15-[4-(11,11-dimethyl-25-phenyl-15,25-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2,4(12),5,7,9,13,17,19,21,23,26-dodecaen-15-yl)phenyl]-11,11-dimethyl-25-phenyl-15,25-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2,4(12),5,7,9,13,17,19,21,23,26-dodecaene
CID 89492388

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole?
The IUPAC name of 9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole (CID 59236047) is 9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole.
What is the SMILES notation for 9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole?
The canonical SMILES for 9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole is CC1(C)c2cc(/C=C(\c3ccccc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc2-c2cc3c(cc21)-c1ccc(/C=C(\c2ccccc2)c2ccc4c(c2)c2ccccc2n4-c2ccccc2)cc1C3(C)C.
What is the InChIKey of 9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole?
The InChIKey is MINGCZNNUHHBOU-VOGGQTKHSA-N. The full InChI is InChI=1S/C76H56N2/c1-75(2)67-43-49(41-61(51-21-9-5-10-22-51)53-35-39-73-65(45-53)59-29-17-19-31-71(59)77(73)55-25-13-7-14-26-55)33-37-57(67)63-48-70-64(47-69(63)75)58-38-34-50(44-68(58)76(70,3)4)42-62(52-23-11-6-12-24-52)54-36-40-74-66(46-54)60-30-18-20-32-72(60)78(74)56-27-15-8-16-28-56/h5-48H,1-4H3/b61-41+,62-42+.
What are the key properties of 9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole?
9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole has a molecular weight of 997.30 g/mol, XLogP of 19.67, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-3-[(E)-1-phenyl-2-[6,6,12,12-tetramethyl-2-[(E)-2-phenyl-2-(9-phenylcarbazol-3-yl)ethenyl]indeno[1,2-b]fluoren-8-yl]ethenyl]carbazole is sourced from PubChem (CID 59236047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).