9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine

C106H134N4Si8 — CID 140862639

IUPAC9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine
SMILESCC(C)(C)C1(C2(C(C)(C)C)c3cc(N(c4ccc([Si](C)(C)C)cc4)c4ccc([Si](C)(C)C)cc4)ccc3-c3ccc(N(c4ccc([Si](C)(C)C)cc4)c4ccc([Si](C)(C)C)cc4)cc32)c2cc(N(c3ccc([Si](C)(C)C)cc3)c3ccc([Si](C)(C)C)cc3)ccc2-c2ccc(N(c3ccc([Si](C)(C)C)cc3)c3ccc([Si](C)(C)C)cc3)cc21
InChIInChI=1S/C106H134N4Si8/c1-103(2,3)105(99-71-83(107(75-31-51-87(52-32-75)111(7,8)9)76-33-53-88(54-34-76)112(10,11)12)47-67-95(99)96-68-48-84(72-100(96)105)108(77-35-55-89(56-36-77)113(13,14)15)78-37-57-90(58-38-78)114(16,17)18)106(104(4,5)6)101-73-85(109(79-39-59-91(60-40-79)115(19,20)21)80-41-61-92(62-42-80)116(22,23)24)49-69-97(101)98-70-50-86(74-102(98)106)110(81-43-63-93(64-44-81)117(25,26)27)82-45-65-94(66-46-82)118(28,29)30/h31-74H,1-30H3
InChIKeyNCCLLSUGKABGRU-UHFFFAOYSA-N
MW1688.95 g/mol
LogP27.25
Rot. Bonds21

About 9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine

9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine (PubChem CID 140862639) has the molecular formula C106H134N4Si8 and a molecular weight of 1688.95 g/mol. Its IUPAC name is 9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine.

Molecular Properties

Compound Name9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine
PubChem CID140862639
Molecular FormulaC106H134N4Si8
Molecular Weight1688.95 g/mol
Exact Mass1686.88
IUPAC Name9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine
SMILESCC(C)(C)C1(C2(C(C)(C)C)c3cc(N(c4ccc([Si](C)(C)C)cc4)c4ccc([Si](C)(C)C)cc4)ccc3-c3ccc(N(c4ccc([Si](C)(C)C)cc4)c4ccc([Si](C)(C)C)cc4)cc32)c2cc(N(c3ccc([Si](C)(C)C)cc3)c3ccc([Si](C)(C)C)cc3)ccc2-c2ccc(N(c3ccc([Si](C)(C)C)cc3)c3ccc([Si](C)(C)C)cc3)cc21
InChIInChI=1S/C106H134N4Si8/c1-103(2,3)105(99-71-83(107(75-31-51-87(52-32-75)111(7,8)9)76-33-53-88(54-34-76)112(10,11)12)47-67-95(99)96-68-48-84(72-100(96)105)108(77-35-55-89(56-36-77)113(13,14)15)78-37-57-90(58-38-78)114(16,17)18)106(104(4,5)6)101-73-85(109(79-39-59-91(60-40-79)115(19,20)21)80-41-61-92(62-42-80)116(22,23)24)49-69-97(101)98-70-50-86(74-102(98)106)110(81-43-63-93(64-44-81)117(25,26)27)82-45-65-94(66-46-82)118(28,29)30/h31-74H,1-30H3
InChIKeyNCCLLSUGKABGRU-UHFFFAOYSA-N
XLogP27.25
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds21
Heavy Atoms118
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001688.95
LogP ≤ 527.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine with MolForge

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Related Compounds

2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine
CID 123150757
N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine
CID 59245955
11,11-dimethyl-2-N,8-N-diphenyl-2-N,8-N-bis(4-trimethylsilylphenyl)benzo[b]fluorene-2,8-diamine
CID 140774313
9,9-dimethyl-N-phenyl-N-(4-trimethylsilylphenyl)-7-[(E)-2-[4-(N-(4-trimethylsilylphenyl)anilino)phenyl]ethenyl]fluoren-2-amine
CID 58444636
9,9-dimethyl-N-[4-(4-trimethylsilylphenyl)phenyl]-N-(4-triphenylsilylphenyl)fluoren-2-amine
CID 123205402
9,9-diethyl-N-phenyl-7-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-N-(4-trimethylsilylphenyl)fluoren-2-amine
CID 58444639
25,25-dimethyl-16-N,28-N-diphenyl-16-N,28-N-bis(4-trimethylsilylphenyl)heptacyclo[20.11.0.02,7.08,13.014,19.024,32.026,31]tritriaconta-1(33),2,4,6,8,10,12,14(19),15,17,20,22,24(32),26(31),27,29-hexadecaene-16,28-diamine
CID 163410937
12-tert-butyl-12-[12-tert-butyl-9-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)-12-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl]-N,N-bis(4-trimethylsilylphenyl)pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-amine
CID 140862634
7-tert-butyl-7-[7-tert-butyl-5,9-bis(4-tert-butyl-N-(4-tert-butylphenyl)anilino)benzo[c]fluoren-7-yl]-5-N,5-N,9-N,9-N-tetrakis(4-tert-butylphenyl)benzo[c]fluorene-5,9-diamine
CID 134432693
N-(9,9-dimethylfluoren-2-yl)-15,15-dimethyl-N-[4-(4-trimethylsilylphenyl)phenyl]tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaen-3-amine
CID 90306203
CID 59246251
CID 59246251
5-N,18-N-bis(4-tert-butylphenyl)-21,21-diphenyl-5-N,18-N-bis(4-trimethylsilylphenyl)pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaene-5,18-diamine
CID 88594445

Frequently Asked Questions

What is the IUPAC name of 9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine?
The IUPAC name of 9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine (CID 140862639) is 9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine.
What is the SMILES notation for 9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine?
The canonical SMILES for 9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine is CC(C)(C)C1(C2(C(C)(C)C)c3cc(N(c4ccc([Si](C)(C)C)cc4)c4ccc([Si](C)(C)C)cc4)ccc3-c3ccc(N(c4ccc([Si](C)(C)C)cc4)c4ccc([Si](C)(C)C)cc4)cc32)c2cc(N(c3ccc([Si](C)(C)C)cc3)c3ccc([Si](C)(C)C)cc3)ccc2-c2ccc(N(c3ccc([Si](C)(C)C)cc3)c3ccc([Si](C)(C)C)cc3)cc21.
What is the InChIKey of 9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine?
The InChIKey is NCCLLSUGKABGRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C106H134N4Si8/c1-103(2,3)105(99-71-83(107(75-31-51-87(52-32-75)111(7,8)9)76-33-53-88(54-34-76)112(10,11)12)47-67-95(99)96-68-48-84(72-100(96)105)108(77-35-55-89(56-36-77)113(13,14)15)78-37-57-90(58-38-78)114(16,17)18)106(104(4,5)6)101-73-85(109(79-39-59-91(60-40-79)115(19,20)21)80-41-61-92(62-42-80)116(22,23)24)49-69-97(101)98-70-50-86(74-102(98)106)110(81-43-63-93(64-44-81)117(25,26)27)82-45-65-94(66-46-82)118(28,29)30/h31-74H,1-30H3.
What are the key properties of 9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine?
9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine has a molecular weight of 1688.95 g/mol, XLogP of 27.25, 21 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-tert-butyl-9-[9-tert-butyl-2,7-bis(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)fluoren-9-yl]-2-N,2-N,7-N,7-N-tetrakis(4-trimethylsilylphenyl)fluorene-2,7-diamine is sourced from PubChem (CID 140862639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).