deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran

C177H116O5 — CID 157084513

About deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran

deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran (PubChem CID 157084513) has the molecular formula C177H116O5 and a molecular weight of 2325.89 g/mol. Its IUPAC name is deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran.

Molecular Properties

• Compound Name: deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran
• PubChem CID: 157084513
• Molecular Formula: C177H116O5
• Molecular Weight: 2325.89 g/mol
• Exact Mass: 2323.90
• IUPAC Name: deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran
• SMILES: [2H]C.[2H]C.[2H]C.c1ccc(-c2c3ccccc3c(-c3cccc4oc5c6ccccc6ccc5c34)c3ccccc23)cc1.c1ccc(-c2ccc3c(oc4ccc5oc6ccccc6c5c43)c2-c2c3ccccc3c(-c3ccc(-c4cccc5ccccc45)c4ccccc34)c3ccccc23)cc1.c1ccc2c(-c3c4ccccc4c(-c4cccc5oc6c7ccccc7ccc6c45)c4ccccc34)cccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5oc6c7ccccc7ccc6c45)c4ccccc34)ccc2c1
• InChI: InChI=1S/C58H34O2.2C40H24O.C36H22O.3CH4/c1-2-15-36(16-3-1)38-29-32-49-56-52(34-33-51-55(56)48-26-12-13-28-50(48)59-51)60-58(49)57(38)54-45-24-10-8-22-43(45)53(44-23-9-11-25-46(44)54)47-31-30-42(40-20-6-7-21-41(40)47)39-27-14-18-35-17-4-5-19-37(35)39;1-3-14-27-25(11-1)13-9-20-29(27)37-30-16-5-7-18-32(30)38(33-19-8-6-17-31(33)37)34-21-10-22-36-39(34)35-24-23-26-12-2-4-15-28(26)40(35)41-36;1-2-12-27-24-28(21-20-25(27)10-1)37-30-14-5-7-16-32(30)38(33-17-8-6-15-31(33)37)34-18-9-19-36-39(34)35-23-22-26-11-3-4-13-29(26)40(35)41-36;1-2-12-24(13-3-1)33-26-15-6-8-17-28(26)34(29-18-9-7-16-27(29)33)30-19-10-20-32-35(30)31-22-21-23-11-4-5-14-25(23)36(31)37-32;;;/h1-34H;2*1-24H;1-22H;3*1H4/i;;;;3*1D
• InChIKey: ADXZUINMHUFIJP-FXAVEGQFSA-N
• XLogP: 52.12
• TPSA: 65.70 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 10
• Heavy Atoms: 182
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2325.89
LogP ≤ 5	52.12
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran?

The IUPAC name of deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran (CID 157084513) is deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran.

What is the SMILES notation for deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran?

The canonical SMILES for deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran is [2H]C.[2H]C.[2H]C.c1ccc(-c2c3ccccc3c(-c3cccc4oc5c6ccccc6ccc5c34)c3ccccc23)cc1.c1ccc(-c2ccc3c(oc4ccc5oc6ccccc6c5c43)c2-c2c3ccccc3c(-c3ccc(-c4cccc5ccccc45)c4ccccc34)c3ccccc23)cc1.c1ccc2c(-c3c4ccccc4c(-c4cccc5oc6c7ccccc7ccc6c45)c4ccccc34)cccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5oc6c7ccccc7ccc6c45)c4ccccc34)ccc2c1.

What is the InChIKey of deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran?

The InChIKey is ADXZUINMHUFIJP-FXAVEGQFSA-N. The full InChI is InChI=1S/C58H34O2.2C40H24O.C36H22O.3CH4/c1-2-15-36(16-3-1)38-29-32-49-56-52(34-33-51-55(56)48-26-12-13-28-50(48)59-51)60-58(49)57(38)54-45-24-10-8-22-43(45)53(44-23-9-11-25-46(44)54)47-31-30-42(40-20-6-7-21-41(40)47)39-27-14-18-35-17-4-5-19-37(35)39;1-3-14-27-25(11-1)13-9-20-29(27)37-30-16-5-7-18-32(30)38(33-19-8-6-17-31(33)37)34-21-10-22-36-39(34)35-24-23-26-12-2-4-15-28(26)40(35)41-36;1-2-12-27-24-28(21-20-25(27)10-1)37-30-14-5-7-16-32(30)38(33-17-8-6-15-31(33)37)34-18-9-19-36-39(34)35-23-22-26-11-3-4-13-29(26)40(35)41-36;1-2-12-24(13-3-1)33-26-15-6-8-17-28(26)34(29-18-9-7-16-27(29)33)30-19-10-20-32-35(30)31-22-21-23-11-4-5-14-25(23)36(31)37-32;;;/h1-34H;2*1-24H;1-22H;3*1H4/i;;;;3*1D.

What are the key properties of deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran?

deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran has a molecular weight of 2325.89 g/mol, XLogP of 52.12, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for deuteriomethane;7-(10-naphthalen-1-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;7-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-6-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran is sourced from PubChem (CID 157084513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).