3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene

C244H148 — CID 158405519

IUPAC3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene
SMILESc1ccc(-c2cc3c(-c4ccccc4)c4c(c(-c5ccccc5-c5ccccc5)c3cc2-c2ccccc2)-c2ccc(-c3ccc5c6c(cccc36)-c3c(-c6ccccc6)ccc(-c6ccccc6-c6ccccc6)c3-5)c3cccc-4c23)cc1.c1ccc(-c2ccc(-c3ccc(-c4ccccc4)c4c3-c3ccc(-c5ccc6c7c(cccc57)-c5c-6c(-c6ccc(-c7ccccc7)cc6)c6cc(-c7ccccc7)c(-c7ccccc7)cc6c5-c5ccccc5)c5cccc-4c35)cc2)cc1.c1ccc2c(-c3ccc(-c4cccc5ccccc45)c4c3-c3cccc5c(-c6ccc7c8c(cccc68)-c6c-7c(-c7cccc8ccccc78)c7ccccc7c6-c6cccc7ccccc67)ccc-4c35)cccc2c1
InChIInChI=1S/2C84H52.C76H44/c1-7-25-53(26-8-1)59-37-19-21-39-62(59)68-48-45-61(55-29-11-3-12-30-55)80-69-43-23-41-66-63(46-49-71(78(66)69)81(68)80)64-47-50-72-79-67(64)42-24-44-70(79)83-77(58-35-17-6-18-36-58)75-51-73(56-31-13-4-14-32-56)74(57-33-15-5-16-34-57)52-76(75)82(84(72)83)65-40-22-20-38-60(65)54-27-9-2-10-28-54;1-7-21-53(22-8-1)55-37-41-60(42-38-55)64-46-45-63(57-25-11-3-12-26-57)81-69-35-19-33-67-65(47-49-71(79(67)69)82(64)81)66-48-50-72-80-68(66)34-20-36-70(80)83-77(61-31-17-6-18-32-61)75-51-73(58-27-13-4-14-28-58)74(59-29-15-5-16-30-59)52-76(75)78(84(72)83)62-43-39-56(40-44-62)54-23-9-2-10-24-54;1-5-25-49-45(17-1)21-11-31-53(49)63-41-42-64(54-32-12-22-46-18-2-6-26-50(46)54)74-67-43-39-55(59-35-15-37-65(69(59)67)73(63)74)56-40-44-68-70-60(56)36-16-38-66(70)75-71(57-33-13-23-47-19-3-7-27-51(47)57)61-29-9-10-30-62(61)72(76(68)75)58-34-14-24-48-20-4-8-28-52(48)58/h2*1-52H;1-44H
InChIKeyGYQHKQSSWUOOGQ-UHFFFAOYSA-N
MW3079.87 g/mol
LogP68.28
Rot. Bonds23

About 3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene

3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene (PubChem CID 158405519) has the molecular formula C244H148 and a molecular weight of 3079.87 g/mol. Its IUPAC name is 3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene.

Molecular Properties

Compound Name3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene
PubChem CID158405519
Molecular FormulaC244H148
Molecular Weight3079.87 g/mol
Exact Mass3077.16
IUPAC Name3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene
SMILESc1ccc(-c2cc3c(-c4ccccc4)c4c(c(-c5ccccc5-c5ccccc5)c3cc2-c2ccccc2)-c2ccc(-c3ccc5c6c(cccc36)-c3c(-c6ccccc6)ccc(-c6ccccc6-c6ccccc6)c3-5)c3cccc-4c23)cc1.c1ccc(-c2ccc(-c3ccc(-c4ccccc4)c4c3-c3ccc(-c5ccc6c7c(cccc57)-c5c-6c(-c6ccc(-c7ccccc7)cc6)c6cc(-c7ccccc7)c(-c7ccccc7)cc6c5-c5ccccc5)c5cccc-4c35)cc2)cc1.c1ccc2c(-c3ccc(-c4cccc5ccccc45)c4c3-c3cccc5c(-c6ccc7c8c(cccc68)-c6c-7c(-c7cccc8ccccc78)c7ccccc7c6-c6cccc7ccccc67)ccc-4c35)cccc2c1
InChIInChI=1S/2C84H52.C76H44/c1-7-25-53(26-8-1)59-37-19-21-39-62(59)68-48-45-61(55-29-11-3-12-30-55)80-69-43-23-41-66-63(46-49-71(78(66)69)81(68)80)64-47-50-72-79-67(64)42-24-44-70(79)83-77(58-35-17-6-18-36-58)75-51-73(56-31-13-4-14-32-56)74(57-33-15-5-16-34-57)52-76(75)82(84(72)83)65-40-22-20-38-60(65)54-27-9-2-10-28-54;1-7-21-53(22-8-1)55-37-41-60(42-38-55)64-46-45-63(57-25-11-3-12-26-57)81-69-35-19-33-67-65(47-49-71(79(67)69)82(64)81)66-48-50-72-80-68(66)34-20-36-70(80)83-77(61-31-17-6-18-32-61)75-51-73(58-27-13-4-14-28-58)74(59-29-15-5-16-30-59)52-76(75)78(84(72)83)62-43-39-56(40-44-62)54-23-9-2-10-24-54;1-5-25-49-45(17-1)21-11-31-53(49)63-41-42-64(54-32-12-22-46-18-2-6-26-50(46)54)74-67-43-39-55(59-35-15-37-65(69(59)67)73(63)74)56-40-44-68-70-60(56)36-16-38-66(70)75-71(57-33-13-23-47-19-3-7-27-51(47)57)61-29-9-10-30-62(61)72(76(68)75)58-34-14-24-48-20-4-8-28-52(48)58/h2*1-52H;1-44H
InChIKeyGYQHKQSSWUOOGQ-UHFFFAOYSA-N
XLogP68.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds23
Heavy Atoms244
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003079.87
LogP ≤ 568.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene with MolForge

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Related Compounds

3-[7,10-bis(2-phenylphenyl)fluoranthen-3-yl]-9,10-diphenyl-7,12-bis(2-phenylphenyl)benzo[k]fluoranthene;3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;7-naphthalen-1-yl-12-naphthalen-2-yl-3-(7-naphthalen-1-yl-10-naphthalen-2-ylfluoranthen-3-yl)benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene
CID 158693129
3-(7,12-dinaphthalen-2-yl-9,10-diphenylbenzo[k]fluoranthen-3-yl)-7,12-dinaphthalen-2-yl-9,10-diphenylbenzo[k]fluoranthene;3-(7,10-diphenylfluoranthen-3-yl)-7,12-diphenylbenzo[k]fluoranthene;3-fluoranthen-3-ylbenzo[k]fluoranthene;7-naphthalen-1-yl-12-naphthalen-2-yl-3-(7-naphthalen-1-yl-12-naphthalen-2-yl-9,10-diphenylbenzo[k]fluoranthen-3-yl)-9,10-diphenylbenzo[k]fluoranthene
CID 158336338
3-[9,10-diphenyl-7,12-bis(4-phenylphenyl)benzo[k]fluoranthen-3-yl]-9,10-diphenyl-7,12-bis(4-phenylphenyl)benzo[k]fluoranthene;7-naphthalen-1-yl-12-naphthalen-2-yl-3-(7-naphthalen-1-yl-12-naphthalen-2-ylbenzo[k]fluoranthen-3-yl)benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[9,10,12-triphenyl-7-(4-phenylphenyl)benzo[k]fluoranthen-4-yl]benzo[k]fluoranthene
CID 162198422
3-(7,12-dinaphthalen-2-yl-9,10-diphenylbenzo[k]fluoranthen-3-yl)-7,12-dinaphthalen-2-yl-9,10-diphenylbenzo[k]fluoranthene;3-(7,10-diphenylfluoranthen-3-yl)-7,12-diphenylbenzo[k]fluoranthene;7-naphthalen-1-yl-12-naphthalen-2-yl-3-(7-naphthalen-1-yl-12-naphthalen-2-yl-9,10-diphenylbenzo[k]fluoranthen-3-yl)-9,10-diphenylbenzo[k]fluoranthene;7-phenyl-4-(7-phenylfluoranthen-3-yl)benzo[k]fluoranthene
CID 158327029
3-(7,10-diphenylfluoranthen-3-yl)-7,9,10,12-tetraphenylbenzo[k]fluoranthene
CID 58988912
3-[9,10-diphenyl-7,12-bis(4-phenylphenyl)benzo[k]fluoranthen-3-yl]-9,10-diphenyl-7,12-bis(4-phenylphenyl)benzo[k]fluoranthene
CID 58988857
12-phenyl-7-(4-phenylphenyl)-4-[12-phenyl-7-(4-phenylphenyl)benzo[k]fluoranthen-4-yl]benzo[k]fluoranthene
CID 58988853
7,36-diphenyl-14,25-bis(2-phenylphenyl)dodecacyclo[21.17.2.22,5.03,19.04,16.06,15.08,13.020,41.024,37.026,35.028,33.038,42]tetratetraconta-1(41),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38(42),39,43-docosaene
CID 59642874
ethane;12-(4-methylphenyl)-4-[12-(4-methylphenyl)-7-(2-phenylphenyl)benzo[k]fluoranthen-4-yl]-7-(2-phenylphenyl)benzo[k]fluoranthene;propane
CID 143743322
3-(4-naphthalen-2-ylphenyl)-7,12-diphenylbenzo[k]fluoranthene
CID 140717774
9-naphthalen-1-yl-2-phenyl-10-(2-phenylphenyl)anthracene
CID 58323636
9-(2-naphthalen-1-ylphenyl)-10-[2-(4-phenylphenyl)phenyl]anthracene;9-(3-naphthalen-1-ylphenyl)-10-[2-(4-phenylphenyl)phenyl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[2-(4-phenylphenyl)phenyl]anthracene;9-(4-phenylphenyl)-10-[2-(4-phenylphenyl)phenyl]anthracene
CID 158722566

Frequently Asked Questions

What is the IUPAC name of 3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene?
The IUPAC name of 3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene (CID 158405519) is 3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene.
What is the SMILES notation for 3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene?
The canonical SMILES for 3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene is c1ccc(-c2cc3c(-c4ccccc4)c4c(c(-c5ccccc5-c5ccccc5)c3cc2-c2ccccc2)-c2ccc(-c3ccc5c6c(cccc36)-c3c(-c6ccccc6)ccc(-c6ccccc6-c6ccccc6)c3-5)c3cccc-4c23)cc1.c1ccc(-c2ccc(-c3ccc(-c4ccccc4)c4c3-c3ccc(-c5ccc6c7c(cccc57)-c5c-6c(-c6ccc(-c7ccccc7)cc6)c6cc(-c7ccccc7)c(-c7ccccc7)cc6c5-c5ccccc5)c5cccc-4c35)cc2)cc1.c1ccc2c(-c3ccc(-c4cccc5ccccc45)c4c3-c3cccc5c(-c6ccc7c8c(cccc68)-c6c-7c(-c7cccc8ccccc78)c7ccccc7c6-c6cccc7ccccc67)ccc-4c35)cccc2c1.
What is the InChIKey of 3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene?
The InChIKey is GYQHKQSSWUOOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C84H52.C76H44/c1-7-25-53(26-8-1)59-37-19-21-39-62(59)68-48-45-61(55-29-11-3-12-30-55)80-69-43-23-41-66-63(46-49-71(78(66)69)81(68)80)64-47-50-72-79-67(64)42-24-44-70(79)83-77(58-35-17-6-18-36-58)75-51-73(56-31-13-4-14-32-56)74(57-33-15-5-16-34-57)52-76(75)82(84(72)83)65-40-22-20-38-60(65)54-27-9-2-10-28-54;1-7-21-53(22-8-1)55-37-41-60(42-38-55)64-46-45-63(57-25-11-3-12-26-57)81-69-35-19-33-67-65(47-49-71(79(67)69)82(64)81)66-48-50-72-80-68(66)34-20-36-70(80)83-77(61-31-17-6-18-32-61)75-51-73(58-27-13-4-14-28-58)74(59-29-15-5-16-30-59)52-76(75)78(84(72)83)62-43-39-56(40-44-62)54-23-9-2-10-24-54;1-5-25-49-45(17-1)21-11-31-53(49)63-41-42-64(54-32-12-22-46-18-2-6-26-50(46)54)74-67-43-39-55(59-35-15-37-65(69(59)67)73(63)74)56-40-44-68-70-60(56)36-16-38-66(70)75-71(57-33-13-23-47-19-3-7-27-51(47)57)61-29-9-10-30-62(61)72(76(68)75)58-34-14-24-48-20-4-8-28-52(48)58/h2*1-52H;1-44H.
What are the key properties of 3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene?
3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene has a molecular weight of 3079.87 g/mol, XLogP of 68.28, 23 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7,10-dinaphthalen-1-ylfluoranthen-3-yl)-7,12-dinaphthalen-1-ylbenzo[k]fluoranthene;9,10,12-triphenyl-7-(2-phenylphenyl)-4-[7-phenyl-10-(2-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene;9,10,12-triphenyl-7-(4-phenylphenyl)-4-[7-phenyl-10-(4-phenylphenyl)fluoranthen-3-yl]benzo[k]fluoranthene is sourced from PubChem (CID 158405519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).