2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene

C118H89N5O9 — CID 159276038

IUPAC2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene
SMILESCc1ccc2oc3ccc(-c4ccc5oc6ccccc6c5c4)cc3c2c1.Cc1ccc2oc3ccccc3c2c1.Cc1ccc2oc3cnccc3c2c1.Cc1ccc2oc3ncccc3c2c1.Cc1cccc2c1oc1ccccc12.Cc1cccc2c1oc1cnccc12.Cc1cccc2c1oc1ncccc12.Cc1ccccc1.Cc1cnc2oc3ccccc3c2c1
InChIInChI=1S/C25H16O2.2C13H10O.5C12H9NO.C7H8/c1-15-6-9-23-19(12-15)21-14-17(8-11-25(21)27-23)16-7-10-24-20(13-16)18-4-2-3-5-22(18)26-24;1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11;1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13;1-8-4-2-5-9-10-6-3-7-13-12(10)14-11(8)9;1-8-2-3-11-10(6-8)9-4-5-13-7-12(9)14-11;1-8-4-5-11-10(7-8)9-3-2-6-13-12(9)14-11;1-8-3-2-4-10-9-5-6-13-7-11(9)14-12(8)10;1-8-6-10-9-4-2-3-5-11(9)14-12(10)13-7-8;1-7-5-3-2-4-6-7/h2-14H,1H3;2*2-8H,1H3;5*2-7H,1H3;2-6H,1H3
InChIKeyKYHZZFATJZNXPC-UHFFFAOYSA-N
MW1721.04 g/mol
LogP33.69
Rot. Bonds1

About 2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene

2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene (PubChem CID 159276038) has the molecular formula C118H89N5O9 and a molecular weight of 1721.04 g/mol. Its IUPAC name is 2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene.

Molecular Properties

Compound Name2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene
PubChem CID159276038
Molecular FormulaC118H89N5O9
Molecular Weight1721.04 g/mol
Exact Mass1719.67
IUPAC Name2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene
SMILESCc1ccc2oc3ccc(-c4ccc5oc6ccccc6c5c4)cc3c2c1.Cc1ccc2oc3ccccc3c2c1.Cc1ccc2oc3cnccc3c2c1.Cc1ccc2oc3ncccc3c2c1.Cc1cccc2c1oc1ccccc12.Cc1cccc2c1oc1cnccc12.Cc1cccc2c1oc1ncccc12.Cc1ccccc1.Cc1cnc2oc3ccccc3c2c1
InChIInChI=1S/C25H16O2.2C13H10O.5C12H9NO.C7H8/c1-15-6-9-23-19(12-15)21-14-17(8-11-25(21)27-23)16-7-10-24-20(13-16)18-4-2-3-5-22(18)26-24;1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11;1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13;1-8-4-2-5-9-10-6-3-7-13-12(10)14-11(8)9;1-8-2-3-11-10(6-8)9-4-5-13-7-12(9)14-11;1-8-4-5-11-10(7-8)9-3-2-6-13-12(9)14-11;1-8-3-2-4-10-9-5-6-13-7-11(9)14-12(8)10;1-8-6-10-9-4-2-3-5-11(9)14-12(10)13-7-8;1-7-5-3-2-4-6-7/h2-14H,1H3;2*2-8H,1H3;5*2-7H,1H3;2-6H,1H3
InChIKeyKYHZZFATJZNXPC-UHFFFAOYSA-N
XLogP33.69
TPSA182.71 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds1
Heavy Atoms132
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001721.04
LogP ≤ 533.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene with MolForge

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Related Compounds

2-methyl-7-(6-methyldibenzofuran-3-yl)dibenzofuran
CID 139460855
6-(4-tetraphenylen-1-ylphenyl)-[1]benzofuro[2,3-b]pyridine;6-(4-tetraphenylen-2-ylphenyl)-[1]benzofuro[2,3-b]pyridine;6-(4-tetraphenylen-1-ylphenyl)-[1]benzofuro[2,3-c]pyridine;6-(4-tetraphenylen-2-ylphenyl)-[1]benzofuro[2,3-c]pyridine
CID 160625322
6-methyl-2-[3-(6-methyldibenzofuran-2-yl)phenyl]dibenzofuran;2-methyl-8-[2-(3-methylphenyl)dibenzofuran-4-yl]dibenzofuran;2-methyl-8-[4-(3-methylphenyl)dibenzofuran-2-yl]dibenzofuran
CID 161457454
1-methyldibenzofuran;2-methyldibenzofuran;4-methyldibenzofuran
CID 158243493
6-[3-[8-([1]benzofuro[2,3-b]pyridin-6-yl)dibenzofuran-2-yl]phenyl]-[1]benzofuro[2,3-b]pyridine;6-[3-[3-[8-([1]benzofuro[2,3-b]pyridin-6-yl)dibenzofuran-2-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]pyridine;6-[3-[3-[3-[8-([1]benzofuro[2,3-b]pyridin-6-yl)dibenzofuran-2-yl]phenyl]phenyl]phenyl]-[1]benzofuro[2,3-b]pyridine;6-[3-[3-[3-[3-[8-([1]benzofuro[2,3-b]pyridin-6-yl)dibenzofuran-2-yl]phenyl]phenyl]phenyl]phenyl]-[1]benzofuro[2,3-b]pyridine
CID 167645998
7-phenyl-[1]benzofuro[2,3-b]pyridine;7-phenyl-[1]benzofuro[3,2-b]pyridine;7-phenyl-[1]benzofuro[2,3-c]pyridine;7-phenyl-[1]benzofuro[3,2-c]pyridine
CID 158403740
3,6-dimethyl-[1]benzofuro[2,3-b]pyridine;4,12-dimethyl-8-oxa-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 162085685
methane;2-methyl-6-[3-(8-methyldibenzofuran-4-yl)phenyl]dibenzofuran;4-methyl-6-[3-(6-methyldibenzofuran-4-yl)phenyl]dibenzofuran;6-methyl-2-[3-(6-methyldibenzofuran-2-yl)phenyl]dibenzofuran;2-methyl-8-[2-(3-methylphenyl)dibenzofuran-4-yl]dibenzofuran;2-methyl-8-[4-(3-methylphenyl)dibenzofuran-2-yl]dibenzofuran
CID 161126679
6-pyridin-2-yl-[1]benzofuro[2,3-c]pyridine
CID 90140834
1-methyl-7-phenyldibenzofuran;1-methyl-8-phenyldibenzofuran;2-methyl-8-phenyldibenzofuran;6-methyl-1-phenyldibenzofuran;6-methyl-2-phenyldibenzofuran;7-methyl-2-phenyldibenzofuran
CID 158698987
6-[8-([1]benzofuro[2,3-b]pyridin-6-yl)dibenzofuran-2-yl]sulfanyl-[1]benzofuro[2,3-b]pyridine
CID 90250541
8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine
CID 144782335

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene?
The IUPAC name of 2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene (CID 159276038) is 2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene.
What is the SMILES notation for 2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene?
The canonical SMILES for 2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene is Cc1ccc2oc3ccc(-c4ccc5oc6ccccc6c5c4)cc3c2c1.Cc1ccc2oc3ccccc3c2c1.Cc1ccc2oc3cnccc3c2c1.Cc1ccc2oc3ncccc3c2c1.Cc1cccc2c1oc1ccccc12.Cc1cccc2c1oc1cnccc12.Cc1cccc2c1oc1ncccc12.Cc1ccccc1.Cc1cnc2oc3ccccc3c2c1.
What is the InChIKey of 2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene?
The InChIKey is KYHZZFATJZNXPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16O2.2C13H10O.5C12H9NO.C7H8/c1-15-6-9-23-19(12-15)21-14-17(8-11-25(21)27-23)16-7-10-24-20(13-16)18-4-2-3-5-22(18)26-24;1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11;1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13;1-8-4-2-5-9-10-6-3-7-13-12(10)14-11(8)9;1-8-2-3-11-10(6-8)9-4-5-13-7-12(9)14-11;1-8-4-5-11-10(7-8)9-3-2-6-13-12(9)14-11;1-8-3-2-4-10-9-5-6-13-7-11(9)14-12(8)10;1-8-6-10-9-4-2-3-5-11(9)14-12(10)13-7-8;1-7-5-3-2-4-6-7/h2-14H,1H3;2*2-8H,1H3;5*2-7H,1H3;2-6H,1H3.
What are the key properties of 2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene?
2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene has a molecular weight of 1721.04 g/mol, XLogP of 33.69, 1 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-2-yl-8-methyldibenzofuran;3-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-b]pyridine;8-methyl-[1]benzofuro[2,3-b]pyridine;6-methyl-[1]benzofuro[2,3-c]pyridine;8-methyl-[1]benzofuro[2,3-c]pyridine;2-methyldibenzofuran;4-methyldibenzofuran;toluene is sourced from PubChem (CID 159276038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).