9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene

C45H34 — CID 145328119

IUPAC9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene
SMILESCc1ccc(C2(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)C3=C4C=CCC3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C45H34/c1-31-24-26-34(27-25-31)45(41-22-12-8-18-36(41)37-19-9-13-23-42(37)45)35-28-29-39-38-20-10-11-21-40(38)44(43(39)30-35,32-14-4-2-5-15-32)33-16-6-3-7-17-33/h2-10,12-20,22-30H,11,21H2,1H3
InChIKeyIPXSNZALHKYQIX-UHFFFAOYSA-N
MW574.77 g/mol
LogP10.81
Rot. Bonds4

About 9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene

9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene (PubChem CID 145328119) has the molecular formula C45H34 and a molecular weight of 574.77 g/mol. Its IUPAC name is 9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene.

Molecular Properties

Compound Name9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene
PubChem CID145328119
Molecular FormulaC45H34
Molecular Weight574.77 g/mol
Exact Mass574.27
IUPAC Name9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene
SMILESCc1ccc(C2(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)C3=C4C=CCC3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C45H34/c1-31-24-26-34(27-25-31)45(41-22-12-8-18-36(41)37-19-9-13-23-42(37)45)35-28-29-39-38-20-10-11-21-40(38)44(43(39)30-35,32-14-4-2-5-15-32)33-16-6-3-7-17-33/h2-10,12-20,22-30H,11,21H2,1H3
InChIKeyIPXSNZALHKYQIX-UHFFFAOYSA-N
XLogP10.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.77
LogP ≤ 510.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3-[9-(4-methylphenyl)-1,2-dihydrofluoren-9-yl]-N-phenylaniline
CID 163520915
9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-10-(9,9-diphenylfluoren-2-yl)-2,6-difluoroanthracene
CID 89208399
10-(4-methylphenyl)-10-phenyl-9H-benzo[a]azulene
CID 142527160
9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-10-(9,9-diphenylfluoren-2-yl)-2-fluoroanthracene
CID 89208400
4-[9-(4-aminophenyl)-1,2-dihydrofluoren-9-yl]aniline
CID 89008919
N,4-diphenyl-N-[4-[4-(9-phenyl-1,2-dihydrofluoren-9-yl)phenyl]phenyl]aniline
CID 70822820
7-phenyl-9-[3-(3-phenylphenyl)phenyl]-9-[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-1,2-dihydrofluorene
CID 145189166
2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene]
CID 142508879
9-[4-[3-[4-[3,6-bis(9,9-diphenylfluoren-2-yl)carbazol-9-yl]phenyl]quinoxalin-2-yl]phenyl]-3-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-6-(9,9-diphenylfluoren-2-yl)carbazole
CID 88956505
methane;2-methyl-9,9-diphenylfluorene
CID 144583572
1-N-(7'-methyl-9,9'-spirobi[fluorene]-2'-yl)-4-N-spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-ylbenzene-1,4-diamine oxide
CID 163766448
1-methyl-4-phenylbenzene;2-methyl-9,9'-spirobi[fluorene];6,9,9-trimethyl-1,2-dihydrofluorene
CID 178165621

Frequently Asked Questions

What is the IUPAC name of 9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene?
The IUPAC name of 9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene (CID 145328119) is 9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene.
What is the SMILES notation for 9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene?
The canonical SMILES for 9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene is Cc1ccc(C2(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)C3=C4C=CCC3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of 9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene?
The InChIKey is IPXSNZALHKYQIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H34/c1-31-24-26-34(27-25-31)45(41-22-12-8-18-36(41)37-19-9-13-23-42(37)45)35-28-29-39-38-20-10-11-21-40(38)44(43(39)30-35,32-14-4-2-5-15-32)33-16-6-3-7-17-33/h2-10,12-20,22-30H,11,21H2,1H3.
What are the key properties of 9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene?
9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene has a molecular weight of 574.77 g/mol, XLogP of 10.81, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene is sourced from PubChem (CID 145328119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).