4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran

C43H30O — CID 66656897

IUPAC4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran
SMILESC1=CC2=C(CC1)c1ccccc1C2(c1ccc(-c2ccccc2)cc1)c1ccc(-c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C43H30O/c1-2-11-29(12-3-1)30-21-25-32(26-22-30)43(39-18-7-4-13-35(39)36-14-5-8-19-40(36)43)33-27-23-31(24-28-33)34-16-10-17-38-37-15-6-9-20-41(37)44-42(34)38/h1-4,6-13,15-28H,5,14H2
InChIKeyQDDCVVMFKZKDNK-UHFFFAOYSA-N
MW562.71 g/mol
LogP11.37
Rot. Bonds4

About 4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran

4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran (PubChem CID 66656897) has the molecular formula C43H30O and a molecular weight of 562.71 g/mol. Its IUPAC name is 4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran.

Molecular Properties

Compound Name4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran
PubChem CID66656897
Molecular FormulaC43H30O
Molecular Weight562.71 g/mol
Exact Mass562.23
IUPAC Name4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran
SMILESC1=CC2=C(CC1)c1ccccc1C2(c1ccc(-c2ccccc2)cc1)c1ccc(-c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C43H30O/c1-2-11-29(12-3-1)30-21-25-32(26-22-30)43(39-18-7-4-13-35(39)36-14-5-8-19-40(36)43)33-27-23-31(24-28-33)34-16-10-17-38-37-15-6-9-20-41(37)44-42(34)38/h1-4,6-13,15-28H,5,14H2
InChIKeyQDDCVVMFKZKDNK-UHFFFAOYSA-N
XLogP11.37
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500562.71
LogP ≤ 511.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-(9-dibenzofuran-4-yl-3,4-dihydrofluoren-9-yl)phenyl]-N-(4-methyl-4-phenylcyclohexa-1,5-dien-1-yl)-4-phenylaniline
CID 144960334
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 121381438
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-4-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-4-(4-phenylphenyl)aniline;N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline
CID 157370193
N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 164768992
4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-N-(4-spiro[3,4-dihydrofluorene-9,7'-fluoreno[2,3-b][1]benzofuran]-6'-ylphenyl)aniline
CID 171799116
N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-N,4-diphenylaniline
CID 164769137
9-(4-dibenzofuran-4-ylphenyl)-N,9-diphenyl-N-(4-phenylphenyl)fluoren-4-amine
CID 164769017
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(2-methylspiro[1H-fluorene-9,9'-fluorene]-2-yl)phenyl]-4-phenylaniline
CID 167231705
4-[4-(4-phenyl-1H-cyclopenta[a]inden-4-yl)phenyl]cyclohepta[b][1]benzofuran
CID 167069128
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-2-(3-phenylphenyl)aniline
CID 121381288
N-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-4-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-4-amine
CID 164769011
9,9-bis(4-tert-butylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]fluoren-4-amine
CID 158201321

Frequently Asked Questions

What is the IUPAC name of 4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran?
The IUPAC name of 4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran (CID 66656897) is 4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran.
What is the SMILES notation for 4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran?
The canonical SMILES for 4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran is C1=CC2=C(CC1)c1ccccc1C2(c1ccc(-c2ccccc2)cc1)c1ccc(-c2cccc3c2oc2ccccc23)cc1.
What is the InChIKey of 4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran?
The InChIKey is QDDCVVMFKZKDNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H30O/c1-2-11-29(12-3-1)30-21-25-32(26-22-30)43(39-18-7-4-13-35(39)36-14-5-8-19-40(36)43)33-27-23-31(24-28-33)34-16-10-17-38-37-15-6-9-20-41(37)44-42(34)38/h1-4,6-13,15-28H,5,14H2.
What are the key properties of 4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran?
4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran has a molecular weight of 562.71 g/mol, XLogP of 11.37, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[9-(4-phenylphenyl)-3,4-dihydrofluoren-9-yl]phenyl]dibenzofuran is sourced from PubChem (CID 66656897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).