6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran

C34H28O — CID 156827136

IUPAC6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran
SMILESCc1ccc(-c2ccc3c(c2)-c2ccc(-c4cccc5c6c(oc45)=CCCC=6)cc2C3(C)C)cc1
InChIInChI=1S/C34H28O/c1-21-11-13-22(14-12-21)23-16-18-30-29(19-23)26-17-15-24(20-31(26)34(30,2)3)25-8-6-9-28-27-7-4-5-10-32(27)35-33(25)28/h6-20H,4-5H2,1-3H3
InChIKeyBQCDVPXOYBPFIA-UHFFFAOYSA-N
MW452.60 g/mol
LogP7.74
Rot. Bonds2

About 6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran

6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran (PubChem CID 156827136) has the molecular formula C34H28O and a molecular weight of 452.60 g/mol. Its IUPAC name is 6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran.

Molecular Properties

Compound Name6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran
PubChem CID156827136
Molecular FormulaC34H28O
Molecular Weight452.60 g/mol
Exact Mass452.21
IUPAC Name6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran
SMILESCc1ccc(-c2ccc3c(c2)-c2ccc(-c4cccc5c6c(oc45)=CCCC=6)cc2C3(C)C)cc1
InChIInChI=1S/C34H28O/c1-21-11-13-22(14-12-21)23-16-18-30-29(19-23)26-17-15-24(20-31(26)34(30,2)3)25-8-6-9-28-27-7-4-5-10-32(27)35-33(25)28/h6-20H,4-5H2,1-3H3
InChIKeyBQCDVPXOYBPFIA-UHFFFAOYSA-N
XLogP7.74
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.60
LogP ≤ 57.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(7,8-dihydrodibenzofuran-4-yl)-5-(9,9-dimethylfluoren-2-yl)aniline
CID 142380719
aniline;3-(7,8-dihydrodibenzofuran-4-yl)-5-(9,9-dimethylfluoren-2-yl)aniline;N,2-diphenylaniline;1-methyl-4-phenylbenzene
CID 142380718
6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene
CID 144585061
ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene
CID 144585060
9,9-dimethyl-3-[3-[4-(4-methylphenyl)phenyl]phenyl]fluorene
CID 156827523
3-dibenzofuran-4-yl-N-[4-(7-dibenzofuran-4-yl-9,9-dimethylfluoren-3-yl)phenyl]-N-phenylaniline
CID 168839393
N-(3-dibenzofuran-4-ylphenyl)-N-[3-(9,9-dimethyl-7-phenylfluoren-3-yl)phenyl]-9,9-dimethylfluoren-2-amine
CID 168839606
18-[9,9-dimethyl-7-(10-naphthalen-1-ylanthracen-9-yl)fluoren-3-yl]-12,16-dioxahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17(22),18,20,23-undecaene
CID 130190369
6-[9,9-dimethyl-7-(4-methylphenyl)fluoren-2-yl]-9,9-dimethylindeno[2,1-b]pyridine
CID 66594307
3-[9,9-dimethyl-7-(10-naphthalen-1-ylanthracen-9-yl)fluoren-2-yl]-11,11-dimethylbenzo[b]fluorene
CID 159143785
7-[9,9-dimethyl-7-(10-naphthalen-1-ylanthracen-9-yl)fluoren-3-yl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.017,22]tetracosa-1(13),2(10),3(8),4,6,11,14(23),15,17,19,21-undecaene
CID 130190368
N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-methylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine;methane;N-naphthalen-2-yl-6-phenyl-N-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]dibenzofuran-4-amine
CID 158266678

Frequently Asked Questions

What is the IUPAC name of 6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran?
The IUPAC name of 6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran (CID 156827136) is 6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran.
What is the SMILES notation for 6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran?
The canonical SMILES for 6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran is Cc1ccc(-c2ccc3c(c2)-c2ccc(-c4cccc5c6c(oc45)=CCCC=6)cc2C3(C)C)cc1.
What is the InChIKey of 6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran?
The InChIKey is BQCDVPXOYBPFIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H28O/c1-21-11-13-22(14-12-21)23-16-18-30-29(19-23)26-17-15-24(20-31(26)34(30,2)3)25-8-6-9-28-27-7-4-5-10-32(27)35-33(25)28/h6-20H,4-5H2,1-3H3.
What are the key properties of 6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran?
6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran has a molecular weight of 452.60 g/mol, XLogP of 7.74, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[9,9-dimethyl-6-(4-methylphenyl)fluoren-2-yl]-2,3-dihydrodibenzofuran is sourced from PubChem (CID 156827136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).