deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran

C151H104O3 — CID 162019105

About deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran

deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran (PubChem CID 162019105) has the molecular formula C151H104O3 and a molecular weight of 1969.51 g/mol. Its IUPAC name is deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran.

Molecular Properties

• Compound Name: deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran
• PubChem CID: 162019105
• Molecular Formula: C151H104O3
• Molecular Weight: 1969.51 g/mol
• Exact Mass: 1967.82
• IUPAC Name: deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran
• SMILES: [2H]C.[2H]C.[2H]C.c1ccc(-c2ccc3c(c2)oc2c(-c4c5ccccc5c(-c5ccc6cccc(-c7ccccc7)c6c5)c5ccccc45)cccc23)cc1.c1ccc(-c2ccc3c(oc4ccccc43)c2-c2c3ccccc3c(-c3ccc(-c4cccc5ccccc45)c4ccccc34)c3ccccc23)cc1.c1ccc(-c2ccc3cccc(-c4c5ccccc5c(-c5cccc6c5oc5ccc(-c7ccccc7)cc56)c5ccccc45)c3c2)cc1
• InChI: InChI=1S/C52H32O.2C48H30O.3CH4/c1-2-15-34(16-3-1)36-29-32-47-41-22-12-13-28-48(41)53-52(47)51(36)50-44-25-10-8-23-42(44)49(43-24-9-11-26-45(43)50)46-31-30-40(38-20-6-7-21-39(38)46)37-27-14-18-33-17-4-5-19-35(33)37;1-3-13-31(14-4-1)34-27-28-37-42-23-12-24-43(48(42)49-45(37)30-34)47-40-20-9-7-18-38(40)46(39-19-8-10-21-41(39)47)35-26-25-33-17-11-22-36(44(33)29-35)32-15-5-2-6-16-32;1-3-13-31(14-4-1)34-26-25-33-17-11-22-40(43(33)29-34)46-36-18-7-9-20-38(36)47(39-21-10-8-19-37(39)46)42-24-12-23-41-44-30-35(32-15-5-2-6-16-32)27-28-45(44)49-48(41)42;;;/h1-32H;2*1-30H;3*1H4/i;;;3*1D
• InChIKey: YUMZVYSVKCQWRA-WMAGKGSMSA-N
• XLogP: 44.20
• TPSA: 39.42 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 12
• Heavy Atoms: 154
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1969.51
LogP ≤ 5	44.20
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran?

The IUPAC name of deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran (CID 162019105) is deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran.

What is the SMILES notation for deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran?

The canonical SMILES for deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran is [2H]C.[2H]C.[2H]C.c1ccc(-c2ccc3c(c2)oc2c(-c4c5ccccc5c(-c5ccc6cccc(-c7ccccc7)c6c5)c5ccccc45)cccc23)cc1.c1ccc(-c2ccc3c(oc4ccccc43)c2-c2c3ccccc3c(-c3ccc(-c4cccc5ccccc45)c4ccccc34)c3ccccc23)cc1.c1ccc(-c2ccc3cccc(-c4c5ccccc5c(-c5cccc6c5oc5ccc(-c7ccccc7)cc56)c5ccccc45)c3c2)cc1.

What is the InChIKey of deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran?

The InChIKey is YUMZVYSVKCQWRA-WMAGKGSMSA-N. The full InChI is InChI=1S/C52H32O.2C48H30O.3CH4/c1-2-15-34(16-3-1)36-29-32-47-41-22-12-13-28-48(41)53-52(47)51(36)50-44-25-10-8-23-42(44)49(43-24-9-11-26-45(43)50)46-31-30-40(38-20-6-7-21-39(38)46)37-27-14-18-33-17-4-5-19-35(33)37;1-3-13-31(14-4-1)34-27-28-37-42-23-12-24-43(48(42)49-45(37)30-34)47-40-20-9-7-18-38(40)46(39-19-8-10-21-41(39)47)35-26-25-33-17-11-22-36(44(33)29-35)32-15-5-2-6-16-32;1-3-13-31(14-4-1)34-26-25-33-17-11-22-40(43(33)29-34)46-36-18-7-9-20-38(36)47(39-21-10-8-19-37(39)46)42-24-12-23-41-44-30-35(32-15-5-2-6-16-32)27-28-45(44)49-48(41)42;;;/h1-32H;2*1-30H;3*1H4/i;;;3*1D.

What are the key properties of deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran?

deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran has a molecular weight of 1969.51 g/mol, XLogP of 44.20, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for deuteriomethane;4-[10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracen-9-yl]-3-phenyldibenzofuran;2-phenyl-6-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-6-[10-(8-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran is sourced from PubChem (CID 162019105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).