(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran

C135H88Br2O3 — CID 158166002

IUPAC(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran
SMILESO=C(c1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1)c1cccc(Br)c1.OC(c1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1)(c1cccc(Br)c1)c1ccccc1-c1ccccc1.c1ccc(-c2c3ccccc3c(-c3ccc(C4(c5cccc(-c6cccc7c6oc6ccccc67)c5)c5ccccc5-c5ccccc54)cc3)c3ccccc23)cc1
InChIInChI=1S/C57H36O.C45H31BrO.C33H21BrO/c1-2-16-37(17-3-1)54-46-23-4-6-25-48(46)55(49-26-7-5-24-47(49)54)38-32-34-40(35-33-38)57(51-29-11-8-20-43(51)44-21-9-12-30-52(44)57)41-19-14-18-39(36-41)42-27-15-28-50-45-22-10-13-31-53(45)58-56(42)50;46-36-19-13-18-35(30-36)45(47,42-25-12-11-20-37(42)31-14-3-1-4-15-31)34-28-26-33(27-29-34)44-40-23-9-7-21-38(40)43(32-16-5-2-6-17-32)39-22-8-10-24-41(39)44;34-26-12-8-11-25(21-26)33(35)24-19-17-23(18-20-24)32-29-15-6-4-13-27(29)31(22-9-2-1-3-10-22)28-14-5-7-16-30(28)32/h1-36H;1-30,47H;1-21H
InChIKeyFWVRSEMZBHBFPU-UHFFFAOYSA-N
MW1917.99 g/mol
LogP36.62
Rot. Bonds15

About (3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran

(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran (PubChem CID 158166002) has the molecular formula C135H88Br2O3 and a molecular weight of 1917.99 g/mol. Its IUPAC name is (3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran.

Molecular Properties

Compound Name(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran
PubChem CID158166002
Molecular FormulaC135H88Br2O3
Molecular Weight1917.99 g/mol
Exact Mass1914.51
IUPAC Name(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran
SMILESO=C(c1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1)c1cccc(Br)c1.OC(c1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1)(c1cccc(Br)c1)c1ccccc1-c1ccccc1.c1ccc(-c2c3ccccc3c(-c3ccc(C4(c5cccc(-c6cccc7c6oc6ccccc67)c5)c5ccccc5-c5ccccc54)cc3)c3ccccc23)cc1
InChIInChI=1S/C57H36O.C45H31BrO.C33H21BrO/c1-2-16-37(17-3-1)54-46-23-4-6-25-48(46)55(49-26-7-5-24-47(49)54)38-32-34-40(35-33-38)57(51-29-11-8-20-43(51)44-21-9-12-30-52(44)57)41-19-14-18-39(36-41)42-27-15-28-50-45-22-10-13-31-53(45)58-56(42)50;46-36-19-13-18-35(30-36)45(47,42-25-12-11-20-37(42)31-14-3-1-4-15-31)34-28-26-33(27-29-34)44-40-23-9-7-21-38(40)43(32-16-5-2-6-17-32)39-22-8-10-24-41(39)44;34-26-12-8-11-25(21-26)33(35)24-19-17-23(18-20-24)32-29-15-6-4-13-27(29)31(22-9-2-1-3-10-22)28-14-5-7-16-30(28)32/h1-36H;1-30,47H;1-21H
InChIKeyFWVRSEMZBHBFPU-UHFFFAOYSA-N
XLogP36.62
TPSA50.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms140
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001917.99
LogP ≤ 536.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze (3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran with MolForge

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Related Compounds

(4-dibenzofuran-4-ylphenyl)-(9,9'-spirobi[fluorene]-2-yl)methanone
CID 59133482
(4-bromophenyl)-(3-dibenzofuran-4-ylphenyl)methanone
CID 66669293
9-[4-[9-(3-bromophenyl)fluoren-9-yl]phenyl]-10-phenylanthracene
CID 87087450
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 121381438
4-phenyl-6-[2-(9-phenylfluoren-9-yl)phenyl]dibenzofuran;4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran;4-phenyl-6-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran
CID 159547141
4-phenyl-6-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran
CID 66686164
N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 164768992
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-2-(3-phenylphenyl)aniline
CID 121381288
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-4-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-4-(4-phenylphenyl)aniline;N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline
CID 157370193
N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-N,4-diphenylaniline
CID 164769137
4-(7-dibenzofuran-4-yl-9,9-diphenylfluoren-2-yl)dibenzofuran
CID 135131477
4-(3-dibenzofuran-4-ylphenyl)-2-phenyl-6-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]pyrimidine
CID 171603283

Frequently Asked Questions

What is the IUPAC name of (3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran?
The IUPAC name of (3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran (CID 158166002) is (3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran.
What is the SMILES notation for (3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran?
The canonical SMILES for (3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran is O=C(c1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1)c1cccc(Br)c1.OC(c1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1)(c1cccc(Br)c1)c1ccccc1-c1ccccc1.c1ccc(-c2c3ccccc3c(-c3ccc(C4(c5cccc(-c6cccc7c6oc6ccccc67)c5)c5ccccc5-c5ccccc54)cc3)c3ccccc23)cc1.
What is the InChIKey of (3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran?
The InChIKey is FWVRSEMZBHBFPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H36O.C45H31BrO.C33H21BrO/c1-2-16-37(17-3-1)54-46-23-4-6-25-48(46)55(49-26-7-5-24-47(49)54)38-32-34-40(35-33-38)57(51-29-11-8-20-43(51)44-21-9-12-30-52(44)57)41-19-14-18-39(36-41)42-27-15-28-50-45-22-10-13-31-53(45)58-56(42)50;46-36-19-13-18-35(30-36)45(47,42-25-12-11-20-37(42)31-14-3-1-4-15-31)34-28-26-33(27-29-34)44-40-23-9-7-21-38(40)43(32-16-5-2-6-17-32)39-22-8-10-24-41(39)44;34-26-12-8-11-25(21-26)33(35)24-19-17-23(18-20-24)32-29-15-6-4-13-27(29)31(22-9-2-1-3-10-22)28-14-5-7-16-30(28)32/h1-36H;1-30,47H;1-21H.
What are the key properties of (3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran?
(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran has a molecular weight of 1917.99 g/mol, XLogP of 36.62, 15 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone;(3-bromophenyl)-[4-(10-phenylanthracen-9-yl)phenyl]-(2-phenylphenyl)methanol;4-[3-[9-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-9-yl]phenyl]dibenzofuran is sourced from PubChem (CID 158166002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).