10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran

C39H26O2 — CID 118553057

IUPAC10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran
SMILESCC1(C)c2ccc(-c3cccc(-c4cccc5c4oc4ccccc45)c3)cc2-c2c1ccc1c2oc2ccccc21
InChIInChI=1S/C39H26O2/c1-39(2)32-19-17-24(22-31(32)36-33(39)20-18-30-28-12-4-6-16-35(28)41-38(30)36)23-9-7-10-25(21-23)26-13-8-14-29-27-11-3-5-15-34(27)40-37(26)29/h3-22H,1-2H3
InChIKeyDOWPHMXJWUOFTB-UHFFFAOYSA-N
MW526.64 g/mol
LogP11.13
Rot. Bonds2

About 10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran

10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran (PubChem CID 118553057) has the molecular formula C39H26O2 and a molecular weight of 526.64 g/mol. Its IUPAC name is 10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran.

Molecular Properties

Compound Name10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran
PubChem CID118553057
Molecular FormulaC39H26O2
Molecular Weight526.64 g/mol
Exact Mass526.19
IUPAC Name10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran
SMILESCC1(C)c2ccc(-c3cccc(-c4cccc5c4oc4ccccc45)c3)cc2-c2c1ccc1c2oc2ccccc21
InChIInChI=1S/C39H26O2/c1-39(2)32-19-17-24(22-31(32)36-33(39)20-18-30-28-12-4-6-16-35(28)41-38(30)36)23-9-7-10-25(21-23)26-13-8-14-29-27-11-3-5-15-34(27)40-37(26)29/h3-22H,1-2H3
InChIKeyDOWPHMXJWUOFTB-UHFFFAOYSA-N
XLogP11.13
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500526.64
LogP ≤ 511.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran with MolForge

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Related Compounds

2-[3-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-10-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 118553010
2-[4-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-10-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 154602556
17,17,34,34-tetramethyl-6,23-dioxanonacyclo[18.14.0.03,18.04,16.05,13.07,12.021,33.022,30.024,29]tetratriaconta-1(20),2,4(16),5(13),7,9,11,14,18,21(33),22(30),24,26,28,31-pentadecaene
CID 58261464
4-[3-(23,23-dimethyl-5-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17,19,21-dodecaenyl)phenyl]dibenzofuran
CID 121444171
4-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-10-yl)phenyl]-2,6-diphenylpyrimidine
CID 154602706
3-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-10-yl)-6,9-diphenylcarbazole
CID 118099085
2-dibenzofuran-4-yl-4-[3-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)phenyl]-6-phenyl-1,3,5-triazine
CID 154602751
N-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-10-yl)-7,7-dimethyl-N-(4-phenylphenyl)fluoreno[4,3-b][1]benzofuran-10-amine
CID 118405235
7,7-dimethyl-9-[4-(10-phenylanthracen-9-yl)phenyl]fluoreno[4,3-b][1]benzofuran
CID 122415883
N-(9,9-dimethylfluoren-4-yl)-7,7-dimethyl-N-(4-phenylphenyl)fluoreno[4,3-b][1]benzofuran-10-amine
CID 142515805
5-(9,9-dimethyl-7-triphenylen-2-ylfluoren-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene
CID 163474399
4-(23,23-dimethyl-5-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17,19,21-dodecaenyl)dibenzofuran
CID 118472826

Frequently Asked Questions

What is the IUPAC name of 10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran?
The IUPAC name of 10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran (CID 118553057) is 10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran.
What is the SMILES notation for 10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran?
The canonical SMILES for 10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran is CC1(C)c2ccc(-c3cccc(-c4cccc5c4oc4ccccc45)c3)cc2-c2c1ccc1c2oc2ccccc21.
What is the InChIKey of 10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran?
The InChIKey is DOWPHMXJWUOFTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H26O2/c1-39(2)32-19-17-24(22-31(32)36-33(39)20-18-30-28-12-4-6-16-35(28)41-38(30)36)23-9-7-10-25(21-23)26-13-8-14-29-27-11-3-5-15-34(27)40-37(26)29/h3-22H,1-2H3.
What are the key properties of 10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran?
10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran has a molecular weight of 526.64 g/mol, XLogP of 11.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran is sourced from PubChem (CID 118553057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).