2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine

C304H238N10O — CID 160589727

IUPAC2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine
SMILESO=C1CCC2(CC1)c1cc(N(c3cccc(-c4ccccc4)c3)c3cccc(-c4ccccc4)c3)ccc1-c1ccc(N(c3cccc(-c4ccccc4)c3)c3cccc(-c4ccccc4)c3)cc12.[H][H].[H][H].c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C3(CCCCC3)c3cc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccccc6)cc5)ccc3-4)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4c(c3)C3(CCCCC3)c3cc(N(c5ccc(-c6ccccc6)cc5)c5cccc6ccccc56)ccc3-4)c3cccc4ccccc34)cc2)cc1.c1ccc(-c2cccc(N(c3ccc4c(c3)C3(CCCCC3)c3cc(N(c5cccc(-c6ccccc6)c5)c5cccc6ccccc56)ccc3-4)c3cccc4ccccc34)c2)cc1.c1ccc(N(c2cc3c4c(c2)CCc2cc(N(c5ccccc5)c5cccc6ccccc56)cc(c2-4)CC3)c2cccc3ccccc23)cc1
InChIInChI=1S/C66H50N2O.C66H52N2.2C62H48N2.C48H36N2.2H2/c69-61-37-39-66(40-38-61)64-45-59(67(55-29-13-25-51(41-55)47-17-5-1-6-18-47)56-30-14-26-52(42-56)48-19-7-2-8-20-48)33-35-62(64)63-36-34-60(46-65(63)66)68(57-31-15-27-53(43-57)49-21-9-3-10-22-49)58-32-16-28-54(44-58)50-23-11-4-12-24-50;1-6-16-48(17-7-1)52-24-32-56(33-25-52)67(57-34-26-53(27-35-57)49-18-8-2-9-19-49)60-40-42-62-63-43-41-61(47-65(63)66(64(62)46-60)44-14-5-15-45-66)68(58-36-28-54(29-37-58)50-20-10-3-11-21-50)59-38-30-55(31-39-59)51-22-12-4-13-23-51;1-4-18-44(19-5-1)48-26-14-28-50(40-48)63(60-32-16-24-46-22-8-10-30-54(46)60)52-34-36-56-57-37-35-53(43-59(57)62(58(56)42-52)38-12-3-13-39-62)64(61-33-17-25-47-23-9-11-31-55(47)61)51-29-15-27-49(41-51)45-20-6-2-7-21-45;1-4-16-44(17-5-1)46-28-32-50(33-29-46)63(60-26-14-22-48-20-8-10-24-54(48)60)52-36-38-56-57-39-37-53(43-59(57)62(58(56)42-52)40-12-3-13-41-62)64(61-27-15-23-49-21-9-11-25-55(49)61)51-34-30-47(31-35-51)45-18-6-2-7-19-45;1-3-17-39(18-4-1)49(45-23-11-15-33-13-7-9-21-43(33)45)41-29-35-25-27-37-31-42(32-38-28-26-36(30-41)47(35)48(37)38)50(40-19-5-2-6-20-40)46-24-12-16-34-14-8-10-22-44(34)46;;/h1-36,41-46H,37-40H2;1-4,6-13,16-43,46-47H,5,14-15,44-45H2;1-2,4-11,14-37,40-43H,3,12-13,38-39H2;1-2,4-11,14-39,42-43H,3,12-13,40-41H2;1-24,29-32H,25-28H2;2*1H
InChIKeyRCVSIQISOODOAT-UHFFFAOYSA-N
MW4047.32 g/mol
LogP84.51
Rot. Bonds42

About 2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine

2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine (PubChem CID 160589727) has the molecular formula C304H238N10O and a molecular weight of 4047.32 g/mol. Its IUPAC name is 2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine.

Molecular Properties

Compound Name2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine
PubChem CID160589727
Molecular FormulaC304H238N10O
Molecular Weight4047.32 g/mol
Exact Mass4043.89
IUPAC Name2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine
SMILESO=C1CCC2(CC1)c1cc(N(c3cccc(-c4ccccc4)c3)c3cccc(-c4ccccc4)c3)ccc1-c1ccc(N(c3cccc(-c4ccccc4)c3)c3cccc(-c4ccccc4)c3)cc12.[H][H].[H][H].c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C3(CCCCC3)c3cc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccccc6)cc5)ccc3-4)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4c(c3)C3(CCCCC3)c3cc(N(c5ccc(-c6ccccc6)cc5)c5cccc6ccccc56)ccc3-4)c3cccc4ccccc34)cc2)cc1.c1ccc(-c2cccc(N(c3ccc4c(c3)C3(CCCCC3)c3cc(N(c5cccc(-c6ccccc6)c5)c5cccc6ccccc56)ccc3-4)c3cccc4ccccc34)c2)cc1.c1ccc(N(c2cc3c4c(c2)CCc2cc(N(c5ccccc5)c5cccc6ccccc56)cc(c2-4)CC3)c2cccc3ccccc23)cc1
InChIInChI=1S/C66H50N2O.C66H52N2.2C62H48N2.C48H36N2.2H2/c69-61-37-39-66(40-38-61)64-45-59(67(55-29-13-25-51(41-55)47-17-5-1-6-18-47)56-30-14-26-52(42-56)48-19-7-2-8-20-48)33-35-62(64)63-36-34-60(46-65(63)66)68(57-31-15-27-53(43-57)49-21-9-3-10-22-49)58-32-16-28-54(44-58)50-23-11-4-12-24-50;1-6-16-48(17-7-1)52-24-32-56(33-25-52)67(57-34-26-53(27-35-57)49-18-8-2-9-19-49)60-40-42-62-63-43-41-61(47-65(63)66(64(62)46-60)44-14-5-15-45-66)68(58-36-28-54(29-37-58)50-20-10-3-11-21-50)59-38-30-55(31-39-59)51-22-12-4-13-23-51;1-4-18-44(19-5-1)48-26-14-28-50(40-48)63(60-32-16-24-46-22-8-10-30-54(46)60)52-34-36-56-57-37-35-53(43-59(57)62(58(56)42-52)38-12-3-13-39-62)64(61-33-17-25-47-23-9-11-31-55(47)61)51-29-15-27-49(41-51)45-20-6-2-7-21-45;1-4-16-44(17-5-1)46-28-32-50(33-29-46)63(60-26-14-22-48-20-8-10-24-54(48)60)52-36-38-56-57-39-37-53(43-59(57)62(58(56)42-52)40-12-3-13-41-62)64(61-27-15-23-49-21-9-11-25-55(49)61)51-34-30-47(31-35-51)45-18-6-2-7-19-45;1-3-17-39(18-4-1)49(45-23-11-15-33-13-7-9-21-43(33)45)41-29-35-25-27-37-31-42(32-38-28-26-36(30-41)47(35)48(37)38)50(40-19-5-2-6-20-40)46-24-12-16-34-14-8-10-22-44(34)46;;/h1-36,41-46H,37-40H2;1-4,6-13,16-43,46-47H,5,14-15,44-45H2;1-2,4-11,14-37,40-43H,3,12-13,38-39H2;1-2,4-11,14-39,42-43H,3,12-13,40-41H2;1-24,29-32H,25-28H2;2*1H
InChIKeyRCVSIQISOODOAT-UHFFFAOYSA-N
XLogP84.51
TPSA49.47 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds42
Heavy Atoms315
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004047.32
LogP ≤ 584.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine with MolForge

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Related Compounds

1-N-[4-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]phenyl]-1-N,4-N-diphenyl-4-N-spiro[cyclohexane-1,9'-fluorene]-2'-ylbenzene-1,4-diamine
CID 59025076
N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]spiro[cyclopentane-1,9'-fluorene]-2'-amine
CID 58672313
N-naphthalen-1-yl-N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]spiro[cyclopentane-1,9'-fluorene]-2'-amine
CID 58672348
1-N-(9,9-dimethylfluoren-2-yl)-4-N-[4-[4-[4-(N-(9,9-dimethylfluoren-2-yl)anilino)-N-naphthalen-1-ylanilino]phenyl]phenyl]-4-N-naphthalen-1-yl-1-N-phenylbenzene-1,4-diamine;4-N-(9,9-dimethylfluoren-2-yl)-1-N-[4-[4-(N-[4-(N-(9,9-dimethylfluoren-2-yl)anilino)phenyl]anilino)phenyl]phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,4-N-diphenyl-4-N-spiro[cyclohexane-1,9'-fluorene]-2'-yl-1-N-[4-[4-(N-[4-(N-spiro[cyclohexane-1,9'-fluorene]-2'-ylanilino)phenyl]anilino)phenyl]phenyl]benzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[4-[N-naphthalen-1-yl-4-(N-spiro[cyclohexane-1,9'-fluorene]-2'-ylanilino)anilino]phenyl]phenyl]-1-N-phenyl-1-N-spiro[cyclohexane-1,9'-fluorene]-2'-ylbenzene-1,4-diamine
CID 158953049
9,9-dimethyl-2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;9,9-dimethyl-2-N-phenanthren-9-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;2-N'-(3,5-diphenylphenyl)-7-N'-naphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;1-N-(3,5-diphenylphenyl)-4-N-naphthalen-1-yl-4-N-naphthalen-2-yl-1-N-(4-phenylphenyl)benzene-1,4-diamine;4-N-(3,5-diphenylphenyl)-4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(3-phenylphenyl)phenyl]benzene-1,4-diamine;4-N-(3,5-diphenylphenyl)-1-N-phenyl-4-N-(4-phenylphenyl)-1-N-[4-(3-phenylphenyl)phenyl]benzene-1,4-diamine;4-N-naphthalen-1-yl-1-N-(4-phenylphenyl)-1-N,4-N-bis[4-(3-phenylphenyl)phenyl]benzene-1,4-diamine;2-N'-naphthalen-1-yl-2-N'-phenyl-7-N'-(4-phenylphenyl)-7-N'-[4-(3-phenylphenyl)phenyl]spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine
CID 159617374
2-N,6-N-di(phenanthren-9-yl)-2-N,6-N-diphenyl-9,10-dihydroanthracene-2,6-diamine;1-N,1-N-diphenyl-4-N-[4-[4-(N-phenylanilino)-N-spiro[cyclopentane-1,9'-fluorene]-2'-ylanilino]phenyl]-4-N-spiro[cyclopentane-1,9'-fluorene]-2'-ylbenzene-1,4-diamine;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 158670928
2-N'-(3,5-diphenylphenyl)-2-N'-phenyl-7-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine
CID 58672384
7-N'-phenyl-2-N',2-N'-bis(4-phenylphenyl)-7-N'-[4-[4-(N-[7'-(4-phenyl-N-(4-phenylphenyl)anilino)spiro[cyclohexane-1,9'-fluorene]-2'-yl]anilino)phenyl]phenyl]spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine
CID 59025081
N-[4-methyl-3-(1-phenylcyclopentyl)phenyl]-N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]spiro[cyclopentane-1,9'-fluorene]-2'-amine
CID 71079801
2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine
CID 58661028
(3R)-5-N'-(9,9-dimethylfluoren-2-yl)-5-N'-naphthalen-1-yl-5-N,5-N-diphenyl-3,3'-spirobi[1,2-dihydroindene]-5,5'-diamine
CID 170780186
9,9-dimethyl-N-[4-[4-[N-naphthalen-1-yl-4-(3-phenylphenyl)anilino]phenyl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine;methane;N-naphthalen-1-yl-N-[4-[4-[N-naphthalen-1-yl-4-(3-phenylphenyl)anilino]phenyl]phenyl]naphthalen-2-amine;N-[4-[4-[N-naphthalen-1-yl-4-(3-phenylphenyl)anilino]phenyl]phenyl]-N,4-diphenylnaphthalen-1-amine;N-[4-[4-[N-naphthalen-1-yl-4-(3-phenylphenyl)anilino]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine;N-[4-[4-(N-(4-naphthalen-1-ylphenyl)-4-phenylanilino)phenyl]phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine;N-[4-[4-[N-naphthalen-1-yl-4-(3-phenylphenyl)anilino]phenyl]phenyl]-N-(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2'-amine;N-[4-[4-[N-naphthalen-1-yl-4-(3-phenylphenyl)anilino]phenyl]phenyl]-N-(4-phenylphenyl)spiro[cyclopentane-1,9'-fluorene]-2'-amine
CID 159230719

Frequently Asked Questions

What is the IUPAC name of 2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine?
The IUPAC name of 2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine (CID 160589727) is 2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine.
What is the SMILES notation for 2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine?
The canonical SMILES for 2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine is O=C1CCC2(CC1)c1cc(N(c3cccc(-c4ccccc4)c3)c3cccc(-c4ccccc4)c3)ccc1-c1ccc(N(c3cccc(-c4ccccc4)c3)c3cccc(-c4ccccc4)c3)cc12.[H][H].[H][H].c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C3(CCCCC3)c3cc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccccc6)cc5)ccc3-4)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4c(c3)C3(CCCCC3)c3cc(N(c5ccc(-c6ccccc6)cc5)c5cccc6ccccc56)ccc3-4)c3cccc4ccccc34)cc2)cc1.c1ccc(-c2cccc(N(c3ccc4c(c3)C3(CCCCC3)c3cc(N(c5cccc(-c6ccccc6)c5)c5cccc6ccccc56)ccc3-4)c3cccc4ccccc34)c2)cc1.c1ccc(N(c2cc3c4c(c2)CCc2cc(N(c5ccccc5)c5cccc6ccccc56)cc(c2-4)CC3)c2cccc3ccccc23)cc1.
What is the InChIKey of 2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine?
The InChIKey is RCVSIQISOODOAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H50N2O.C66H52N2.2C62H48N2.C48H36N2.2H2/c69-61-37-39-66(40-38-61)64-45-59(67(55-29-13-25-51(41-55)47-17-5-1-6-18-47)56-30-14-26-52(42-56)48-19-7-2-8-20-48)33-35-62(64)63-36-34-60(46-65(63)66)68(57-31-15-27-53(43-57)49-21-9-3-10-22-49)58-32-16-28-54(44-58)50-23-11-4-12-24-50;1-6-16-48(17-7-1)52-24-32-56(33-25-52)67(57-34-26-53(27-35-57)49-18-8-2-9-19-49)60-40-42-62-63-43-41-61(47-65(63)66(64(62)46-60)44-14-5-15-45-66)68(58-36-28-54(29-37-58)50-20-10-3-11-21-50)59-38-30-55(31-39-59)51-22-12-4-13-23-51;1-4-18-44(19-5-1)48-26-14-28-50(40-48)63(60-32-16-24-46-22-8-10-30-54(46)60)52-34-36-56-57-37-35-53(43-59(57)62(58(56)42-52)38-12-3-13-39-62)64(61-33-17-25-47-23-9-11-31-55(47)61)51-29-15-27-49(41-51)45-20-6-2-7-21-45;1-4-16-44(17-5-1)46-28-32-50(33-29-46)63(60-26-14-22-48-20-8-10-24-54(48)60)52-36-38-56-57-39-37-53(43-59(57)62(58(56)42-52)40-12-3-13-41-62)64(61-27-15-23-49-21-9-11-25-55(49)61)51-34-30-47(31-35-51)45-18-6-2-7-19-45;1-3-17-39(18-4-1)49(45-23-11-15-33-13-7-9-21-43(33)45)41-29-35-25-27-37-31-42(32-38-28-26-36(30-41)47(35)48(37)38)50(40-19-5-2-6-20-40)46-24-12-16-34-14-8-10-22-44(34)46;;/h1-36,41-46H,37-40H2;1-4,6-13,16-43,46-47H,5,14-15,44-45H2;1-2,4-11,14-37,40-43H,3,12-13,38-39H2;1-2,4-11,14-39,42-43H,3,12-13,40-41H2;1-24,29-32H,25-28H2;2*1H.
What are the key properties of 2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine?
2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine has a molecular weight of 4047.32 g/mol, XLogP of 84.51, 42 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2',7'-bis(3-phenyl-N-(3-phenylphenyl)anilino)spiro[cyclohexane-4,9'-fluorene]-1-one;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(3-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N',7-N'-dinaphthalen-1-yl-2-N',7-N'-bis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine;2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenyl-4,5,9,10-tetrahydropyrene-2,7-diamine;molecular hydrogen;2-N',2-N',7-N',7-N'-tetrakis(4-phenylphenyl)spiro[cyclohexane-1,9'-fluorene]-2',7'-diamine is sourced from PubChem (CID 160589727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).