2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene]

C211H146 — CID 159597315

IUPAC2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene]
SMILESC(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc3c(c2)C2(CCCCC2)c2cc(-c4ccc5c(c4)C4(Cc6ccccc6C4)c4ccccc4-5)ccc2-3)cc1.c1ccc2c(c1)CC1(C2)c2ccccc2-c2ccc(-c3cccc4c(-c5ccc(-c6cccc7c(-c8ccc9c(c8)C8(Cc%10ccccc%10C8)c8ccccc8-9)cccc67)cc5)cccc34)cc21.c1ccc2c(c1)CC1(C2)c2ccccc2-c2ccc(-c3cccc4c3ccc3c5ccccc5c(-c5ccc(-c6cc7c8ccccc8c(-c8ccc9c(c8)C8(Cc%10ccccc%10C8)c8ccccc8-9)cc7c7ccccc67)cc5)cc43)cc21
InChIInChI=1S/C84H54.C68H46.C59H46/c1-2-17-56-48-83(47-55(56)16-1)79-30-13-11-26-69(79)71-38-36-53(42-81(71)83)59-28-15-29-66-67(59)40-41-68-60-20-5-6-21-61(60)73(44-76(66)68)51-32-34-52(35-33-51)74-45-77-65-25-10-8-23-63(65)75(46-78(77)64-24-9-7-22-62(64)74)54-37-39-72-70-27-12-14-31-80(70)84(82(72)43-54)49-57-18-3-4-19-58(57)50-84;1-2-14-48-40-67(39-47(48)13-1)63-27-7-5-17-59(63)61-35-33-45(37-65(61)67)53-21-11-23-55-51(19-9-25-57(53)55)43-29-31-44(32-30-43)52-20-10-26-58-54(22-12-24-56(52)58)46-34-36-62-60-18-6-8-28-64(60)68(66(62)38-46)41-49-15-3-4-16-50(49)42-68;1-4-14-42(15-5-1)53(43-16-6-2-7-17-43)34-40-22-24-41(25-23-40)44-26-29-51-52-31-28-45(36-56(52)58(55(51)35-44)32-12-3-13-33-58)46-27-30-50-49-20-10-11-21-54(49)59(57(50)37-46)38-47-18-8-9-19-48(47)39-59/h1-46H,47-50H2;1-38H,39-42H2;1-2,4-11,14-31,34-37H,3,12-13,32-33,38-39H2
InChIKeyMLACKSDBPRUCEB-UHFFFAOYSA-N
MW2681.49 g/mol
LogP53.10
Rot. Bonds13

About 2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene]

2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene] (PubChem CID 159597315) has the molecular formula C211H146 and a molecular weight of 2681.49 g/mol. Its IUPAC name is 2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene].

Molecular Properties

Compound Name2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene]
PubChem CID159597315
Molecular FormulaC211H146
Molecular Weight2681.49 g/mol
Exact Mass2679.14
IUPAC Name2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene]
SMILESC(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc3c(c2)C2(CCCCC2)c2cc(-c4ccc5c(c4)C4(Cc6ccccc6C4)c4ccccc4-5)ccc2-3)cc1.c1ccc2c(c1)CC1(C2)c2ccccc2-c2ccc(-c3cccc4c(-c5ccc(-c6cccc7c(-c8ccc9c(c8)C8(Cc%10ccccc%10C8)c8ccccc8-9)cccc67)cc5)cccc34)cc21.c1ccc2c(c1)CC1(C2)c2ccccc2-c2ccc(-c3cccc4c3ccc3c5ccccc5c(-c5ccc(-c6cc7c8ccccc8c(-c8ccc9c(c8)C8(Cc%10ccccc%10C8)c8ccccc8-9)cc7c7ccccc67)cc5)cc43)cc21
InChIInChI=1S/C84H54.C68H46.C59H46/c1-2-17-56-48-83(47-55(56)16-1)79-30-13-11-26-69(79)71-38-36-53(42-81(71)83)59-28-15-29-66-67(59)40-41-68-60-20-5-6-21-61(60)73(44-76(66)68)51-32-34-52(35-33-51)74-45-77-65-25-10-8-23-63(65)75(46-78(77)64-24-9-7-22-62(64)74)54-37-39-72-70-27-12-14-31-80(70)84(82(72)43-54)49-57-18-3-4-19-58(57)50-84;1-2-14-48-40-67(39-47(48)13-1)63-27-7-5-17-59(63)61-35-33-45(37-65(61)67)53-21-11-23-55-51(19-9-25-57(53)55)43-29-31-44(32-30-43)52-20-10-26-58-54(22-12-24-56(52)58)46-34-36-62-60-18-6-8-28-64(60)68(66(62)38-46)41-49-15-3-4-16-50(49)42-68;1-4-14-42(15-5-1)53(43-16-6-2-7-17-43)34-40-22-24-41(25-23-40)44-26-29-51-52-31-28-45(36-56(52)58(55(51)35-44)32-12-3-13-33-58)46-27-30-50-49-20-10-11-21-54(49)59(57(50)37-46)38-47-18-8-9-19-48(47)39-59/h1-46H,47-50H2;1-38H,39-42H2;1-2,4-11,14-31,34-37H,3,12-13,32-33,38-39H2
InChIKeyMLACKSDBPRUCEB-UHFFFAOYSA-N
XLogP53.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds13
Heavy Atoms211
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002681.49
LogP ≤ 553.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene] with MolForge

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Related Compounds

2-[4-[10-[4-(2,2-diphenylethenyl)phenyl]anthracen-9-yl]phenyl]-9,9'-spirobi[fluorene];2'-[3-[10-[4-(2,2-diphenylethenyl)phenyl]anthracen-9-yl]phenyl]spiro[cyclohexane-1,9'-fluorene];2'-[3-[10-[4-(2,2-diphenylethenyl)phenyl]anthracen-9-yl]phenyl]spiro[cyclopentane-1,9'-fluorene];2'-[3-[10-[4-(2,2-diphenylethenyl)phenyl]anthracen-9-yl]phenyl]spiro[1,3-dihydroindene-2,9'-fluorene]
CID 158291973
2',7'-bis[3-(2,2-diphenylethenyl)-5-naphthalen-1-ylphenyl]spiro[cyclohexane-1,9'-fluorene]
CID 59217297
2'-[5-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene]
CID 58814378
2'-phenylspiro[cyclohexane-1,9'-fluorene]
CID 123183554
6,12-bis(4-benzo[c]phenanthren-5-ylphenyl)chrysene;6,12-bis(3-naphthalen-1-ylphenyl)chrysene;6,12-bis(4-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)chrysene;6,12-bis(4-triphenylen-2-ylphenyl)chrysene
CID 158482253
2,4-diphenyl-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]pyrimidine;2,4-diphenyl-6-[3-[3-(3-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[3-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(3-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]pyrimidine;4-phenyl-6-(4-phenylphenyl)-2-(2-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)pyrimidine
CID 159818880
2-phenyl-4-(4-phenylphenyl)-6-[4-[3-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]pyrimidine
CID 158061276
2,4-diphenyl-6-[3-[3-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 160674553
2-phenyl-4-(4-phenylphenyl)-6-[4-[3-(3-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]pyrimidine;2-phenyl-4-(4-phenylphenyl)-6-[4-[3-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]pyrimidine;2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(3-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]pyrimidine;2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]pyrimidine
CID 158061273
2-phenyl-4-(3-phenylphenyl)-6-[3-[4-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 159514358
2-phenyl-4-(4-phenylphenyl)-6-[3-[3-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 159556137
2'-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylbenzo[c]phenanthren-8-yl)spiro[1,3-dihydroindene-2,9'-fluorene]
CID 59282121

Frequently Asked Questions

What is the IUPAC name of 2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene]?
The IUPAC name of 2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene] (CID 159597315) is 2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene].
What is the SMILES notation for 2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene]?
The canonical SMILES for 2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene] is C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc3c(c2)C2(CCCCC2)c2cc(-c4ccc5c(c4)C4(Cc6ccccc6C4)c4ccccc4-5)ccc2-3)cc1.c1ccc2c(c1)CC1(C2)c2ccccc2-c2ccc(-c3cccc4c(-c5ccc(-c6cccc7c(-c8ccc9c(c8)C8(Cc%10ccccc%10C8)c8ccccc8-9)cccc67)cc5)cccc34)cc21.c1ccc2c(c1)CC1(C2)c2ccccc2-c2ccc(-c3cccc4c3ccc3c5ccccc5c(-c5ccc(-c6cc7c8ccccc8c(-c8ccc9c(c8)C8(Cc%10ccccc%10C8)c8ccccc8-9)cc7c7ccccc67)cc5)cc43)cc21.
What is the InChIKey of 2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene]?
The InChIKey is MLACKSDBPRUCEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H54.C68H46.C59H46/c1-2-17-56-48-83(47-55(56)16-1)79-30-13-11-26-69(79)71-38-36-53(42-81(71)83)59-28-15-29-66-67(59)40-41-68-60-20-5-6-21-61(60)73(44-76(66)68)51-32-34-52(35-33-51)74-45-77-65-25-10-8-23-63(65)75(46-78(77)64-24-9-7-22-62(64)74)54-37-39-72-70-27-12-14-31-80(70)84(82(72)43-54)49-57-18-3-4-19-58(57)50-84;1-2-14-48-40-67(39-47(48)13-1)63-27-7-5-17-59(63)61-35-33-45(37-65(61)67)53-21-11-23-55-51(19-9-25-57(53)55)43-29-31-44(32-30-43)52-20-10-26-58-54(22-12-24-56(52)58)46-34-36-62-60-18-6-8-28-64(60)68(66(62)38-46)41-49-15-3-4-16-50(49)42-68;1-4-14-42(15-5-1)53(43-16-6-2-7-17-43)34-40-22-24-41(25-23-40)44-26-29-51-52-31-28-45(36-56(52)58(55(51)35-44)32-12-3-13-33-58)46-27-30-50-49-20-10-11-21-54(49)59(57(50)37-46)38-47-18-8-9-19-48(47)39-59/h1-46H,47-50H2;1-38H,39-42H2;1-2,4-11,14-31,34-37H,3,12-13,32-33,38-39H2.
What are the key properties of 2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene]?
2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene] has a molecular weight of 2681.49 g/mol, XLogP of 53.10, 13 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-[7'-[4-(2,2-diphenylethenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2'-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[6-[4-(12-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylchrysen-6-yl)phenyl]chrysen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene];2'-[5-[4-(5-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylnaphthalen-1-yl)phenyl]naphthalen-1-yl]spiro[1,3-dihydroindene-2,9'-fluorene] is sourced from PubChem (CID 159597315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).