7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene

C200H225Cl — CID 169036237

IUPAC7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene
SMILESCCCCCCCCC1(CCCCCCC)c2cc(-c3ccc(-c4ccc5c(c4)C(C)(C)c4cc(-c6ccc7c(c6)C(CCCCCCCC)(CCCCCCCC)c6ccccc6-7)ccc4-5)cc3)ccc2-c2ccc(-c3cc(C)c4c(c3)C(C)(C)c3cc(-c5ccc(-c6ccc7c(c6)C(CCCCCCCC)(CCCCCCCC)c6cc(-c8ccc9c(c8)C(C)(C)c8cc(-c%10ccc(-c%11ccc%12c(c%11)C(CCCCCCCC)(CCCCCCCC)c%11cc(-c%13ccc%14c(c%13)C(C)(C)c%13cc(-c%15ccc(Cl)cc%15)ccc%13-%14)ccc%11-%12)cc%10)ccc8-9)ccc6-7)cc5)ccc3-4)cc21
InChIInChI=1S/C200H225Cl/c1-18-26-34-42-50-60-113-197(114-61-51-43-35-27-19-2)176-68-58-57-67-161(176)168-108-92-155(132-184(168)197)152-89-102-165-162-99-83-145(122-177(162)193(10,11)180(165)126-152)139-71-77-142(78-72-139)151-88-107-171-174-111-95-158(135-190(174)200(187(171)131-151,115-59-49-41-33-25-8)120-66-56-48-40-32-24-7)159-121-137(9)192-175-112-96-148(125-183(175)196(16,17)191(192)136-159)140-73-79-143(80-74-140)150-87-106-170-173-109-93-156(133-188(173)199(186(170)130-150,118-64-54-46-38-30-22-5)119-65-55-47-39-31-23-6)153-90-103-166-163-100-84-146(123-178(163)194(12,13)181(166)127-153)138-69-75-141(76-70-138)149-86-105-169-172-110-94-157(134-189(172)198(185(169)129-149,116-62-52-44-36-28-20-3)117-63-53-45-37-29-21-4)154-91-104-167-164-101-85-147(144-81-97-160(201)98-82-144)124-179(164)195(14,15)182(167)128-154/h57-58,67-112,121-136H,18-56,59-66,113-120H2,1-17H3
InChIKeyIDKMHTSMWRPRMT-UHFFFAOYSA-N
MW2664.45 g/mol
LogP60.89
Rot. Bonds66

About 7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene

7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene (PubChem CID 169036237) has the molecular formula C200H225Cl and a molecular weight of 2664.45 g/mol. Its IUPAC name is 7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene.

Molecular Properties

Compound Name7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene
PubChem CID169036237
Molecular FormulaC200H225Cl
Molecular Weight2664.45 g/mol
Exact Mass2661.73
IUPAC Name7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene
SMILESCCCCCCCCC1(CCCCCCC)c2cc(-c3ccc(-c4ccc5c(c4)C(C)(C)c4cc(-c6ccc7c(c6)C(CCCCCCCC)(CCCCCCCC)c6ccccc6-7)ccc4-5)cc3)ccc2-c2ccc(-c3cc(C)c4c(c3)C(C)(C)c3cc(-c5ccc(-c6ccc7c(c6)C(CCCCCCCC)(CCCCCCCC)c6cc(-c8ccc9c(c8)C(C)(C)c8cc(-c%10ccc(-c%11ccc%12c(c%11)C(CCCCCCCC)(CCCCCCCC)c%11cc(-c%13ccc%14c(c%13)C(C)(C)c%13cc(-c%15ccc(Cl)cc%15)ccc%13-%14)ccc%11-%12)cc%10)ccc8-9)ccc6-7)cc5)ccc3-4)cc21
InChIInChI=1S/C200H225Cl/c1-18-26-34-42-50-60-113-197(114-61-51-43-35-27-19-2)176-68-58-57-67-161(176)168-108-92-155(132-184(168)197)152-89-102-165-162-99-83-145(122-177(162)193(10,11)180(165)126-152)139-71-77-142(78-72-139)151-88-107-171-174-111-95-158(135-190(174)200(187(171)131-151,115-59-49-41-33-25-8)120-66-56-48-40-32-24-7)159-121-137(9)192-175-112-96-148(125-183(175)196(16,17)191(192)136-159)140-73-79-143(80-74-140)150-87-106-170-173-109-93-156(133-188(173)199(186(170)130-150,118-64-54-46-38-30-22-5)119-65-55-47-39-31-23-6)153-90-103-166-163-100-84-146(123-178(163)194(12,13)181(166)127-153)138-69-75-141(76-70-138)149-86-105-169-172-110-94-157(134-189(172)198(185(169)129-149,116-62-52-44-36-28-20-3)117-63-53-45-37-29-21-4)154-91-104-167-164-101-85-147(144-81-97-160(201)98-82-144)124-179(164)195(14,15)182(167)128-154/h57-58,67-112,121-136H,18-56,59-66,113-120H2,1-17H3
InChIKeyIDKMHTSMWRPRMT-UHFFFAOYSA-N
XLogP60.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds66
Heavy Atoms201
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002664.45
LogP ≤ 560.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene with MolForge

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Related Compounds

7-[4-[7-[7-[4-[7-(4-chlorophenyl)-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene
CID 169036189
2-chloro-8-[4-[7-[7-[4-[7-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-5,9,9-trimethylfluoren-2-yl]phenyl]-9,9-dioctylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-6,6,12,12-tetraoctylindeno[1,2-b]fluorene
CID 169036242
2-chloro-7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluorene
CID 138569718
2-(4-bromo-3,5-dimethylphenyl)-7-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 145436592
2-[9,9-dimethyl-7-(4-methylnaphthalen-1-yl)fluoren-2-yl]-7-[4-[7-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dioctylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dioctylfluorene
CID 169036311
8,30-bis[4-[7-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,5-dimethylphenyl]-5,5,19,19,33,33-hexamethylnonacyclo[18.15.0.02,18.04,16.06,15.09,14.022,34.023,32.024,29]pentatriaconta-1(35),2,4(16),6(15),7,9,11,13,17,20,22(34),23(32),24,26,28,30-hexadecaene
CID 156624078
8,30-bis[4-[7-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-2,5-dimethylphenyl]-5,5,33,33-tetramethyl-19,19-dioctylnonacyclo[18.15.0.02,18.04,16.06,15.09,14.022,34.023,32.024,29]pentatriaconta-1(35),2,4(16),6(15),7,9,11,13,17,20,22(34),23(32),24,26,28,30-hexadecaene
CID 156624166
8,30-bis[4-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-3-methylphenyl]-19-heptyl-5,5,33,33-tetramethyl-19-octylnonacyclo[18.15.0.02,18.04,16.06,15.09,14.022,34.023,32.024,29]pentatriaconta-1(35),2,4(16),6(15),7,9,11,13,17,20,22(34),23(32),24,26,28,30-hexadecaene
CID 168838247
9,9-dioctyl-2-(4-phenylphenyl)fluorene
CID 101073015
2-bromo-7-[7-(9,9-dihexylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 59512866
8-[4-(6,6-diheptyl-12,12-dioctylindeno[1,2-b]fluoren-2-yl)-2,5-dimethylphenyl]-30-[2,5-dimethyl-4-(6,6,12,12-tetraoctylindeno[1,2-b]fluoren-2-yl)phenyl]-5,5,33,33-tetramethyl-19,19-dioctylnonacyclo[18.15.0.02,18.04,16.06,15.09,14.022,34.023,32.024,29]pentatriaconta-1(35),2,4(16),6(15),7,9,11,13,17,20,22(34),23(32),24,26,28,30-hexadecaene
CID 168838146
8,30-bis[4-[7-(9,9-dimethylfluoren-2-yl)-9,9-dioctylfluoren-2-yl]phenyl]-5,5,33,33-tetramethyl-19,19-dioctylnonacyclo[18.15.0.02,18.04,16.06,15.09,14.022,34.023,32.024,29]pentatriaconta-1(35),2,4(16),6(15),7,9,11,13,17,20,22(34),23(32),24,26,28,30-hexadecaene
CID 156624104

Frequently Asked Questions

What is the IUPAC name of 7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene?
The IUPAC name of 7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene (CID 169036237) is 7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene.
What is the SMILES notation for 7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene?
The canonical SMILES for 7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene is CCCCCCCCC1(CCCCCCC)c2cc(-c3ccc(-c4ccc5c(c4)C(C)(C)c4cc(-c6ccc7c(c6)C(CCCCCCCC)(CCCCCCCC)c6ccccc6-7)ccc4-5)cc3)ccc2-c2ccc(-c3cc(C)c4c(c3)C(C)(C)c3cc(-c5ccc(-c6ccc7c(c6)C(CCCCCCCC)(CCCCCCCC)c6cc(-c8ccc9c(c8)C(C)(C)c8cc(-c%10ccc(-c%11ccc%12c(c%11)C(CCCCCCCC)(CCCCCCCC)c%11cc(-c%13ccc%14c(c%13)C(C)(C)c%13cc(-c%15ccc(Cl)cc%15)ccc%13-%14)ccc%11-%12)cc%10)ccc8-9)ccc6-7)cc5)ccc3-4)cc21.
What is the InChIKey of 7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene?
The InChIKey is IDKMHTSMWRPRMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C200H225Cl/c1-18-26-34-42-50-60-113-197(114-61-51-43-35-27-19-2)176-68-58-57-67-161(176)168-108-92-155(132-184(168)197)152-89-102-165-162-99-83-145(122-177(162)193(10,11)180(165)126-152)139-71-77-142(78-72-139)151-88-107-171-174-111-95-158(135-190(174)200(187(171)131-151,115-59-49-41-33-25-8)120-66-56-48-40-32-24-7)159-121-137(9)192-175-112-96-148(125-183(175)196(16,17)191(192)136-159)140-73-79-143(80-74-140)150-87-106-170-173-109-93-156(133-188(173)199(186(170)130-150,118-64-54-46-38-30-22-5)119-65-55-47-39-31-23-6)153-90-103-166-163-100-84-146(123-178(163)194(12,13)181(166)127-153)138-69-75-141(76-70-138)149-86-105-169-172-110-94-157(134-189(172)198(185(169)129-149,116-62-52-44-36-28-20-3)117-63-53-45-37-29-21-4)154-91-104-167-164-101-85-147(144-81-97-160(201)98-82-144)124-179(164)195(14,15)182(167)128-154/h57-58,67-112,121-136H,18-56,59-66,113-120H2,1-17H3.
What are the key properties of 7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene?
7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene has a molecular weight of 2664.45 g/mol, XLogP of 60.89, 66 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-[7-[7-[4-[7-[7-(4-chlorophenyl)-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dioctylfluoren-2-yl]phenyl]-2-[7-[4-[7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-9-heptyl-9-octylfluoren-2-yl]-4,9,9-trimethylfluorene is sourced from PubChem (CID 169036237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).