10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide

C48H30NO3P — CID 140937119

IUPAC10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide
SMILESO=P1(c2ccccc2)c2ccccc2Oc2c(-c3cc(-n4c5ccccc5c5cc(-c6ccccc6)ccc54)cc4c3oc3ccccc34)cccc21
InChIInChI=1S/C48H30NO3P/c50-53(34-16-5-2-6-17-34)45-24-12-11-23-44(45)52-48-37(20-13-25-46(48)53)40-30-33(29-39-36-19-8-10-22-43(36)51-47(39)40)49-41-21-9-7-18-35(41)38-28-32(26-27-42(38)49)31-14-3-1-4-15-31/h1-30H
InChIKeyFKDLXNLQJNFKCP-UHFFFAOYSA-N
MW699.75 g/mol
LogP11.76
Rot. Bonds4

About 10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide

10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide (PubChem CID 140937119) has the molecular formula C48H30NO3P and a molecular weight of 699.75 g/mol. Its IUPAC name is 10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide.

Molecular Properties

Compound Name10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide
PubChem CID140937119
Molecular FormulaC48H30NO3P
Molecular Weight699.75 g/mol
Exact Mass699.20
IUPAC Name10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide
SMILESO=P1(c2ccccc2)c2ccccc2Oc2c(-c3cc(-n4c5ccccc5c5cc(-c6ccccc6)ccc54)cc4c3oc3ccccc34)cccc21
InChIInChI=1S/C48H30NO3P/c50-53(34-16-5-2-6-17-34)45-24-12-11-23-44(45)52-48-37(20-13-25-46(48)53)40-30-33(29-39-36-19-8-10-22-43(36)51-47(39)40)49-41-21-9-7-18-35(41)38-28-32(26-27-42(38)49)31-14-3-1-4-15-31/h1-30H
InChIKeyFKDLXNLQJNFKCP-UHFFFAOYSA-N
XLogP11.76
TPSA44.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500699.75
LogP ≤ 511.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

9-(6-dibenzofuran-4-yldibenzofuran-2-yl)-3-phenylcarbazole
CID 146532981
3-[3-[3-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]-9-phenylcarbazole
CID 121262432
3-dibenzofuran-4-yl-9-[4-[8-(3-dibenzofuran-4-ylcarbazol-9-yl)dibenzofuran-2-yl]phenyl]carbazole
CID 121449462
3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 134313296
3-dibenzofuran-4-yl-9-(3-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 121449361
N-[4-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 90207163
4-(4-bromophenyl)dibenzofuran;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 158714965
3-[8-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 137474197
9-[3-(8-carbazol-9-yldibenzofuran-4-yl)phenyl]-3-dibenzofuran-4-ylcarbazole
CID 58099745
9-phenyl-3-[3-(6-phenyldibenzofuran-2-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 122492344
3-(3-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole
CID 137466609
9-(6-carbazol-9-yldibenzofuran-2-yl)-3-(8-carbazol-9-yldibenzofuran-4-yl)carbazole;3-[6-[9-(6-carbazol-9-yldibenzofuran-2-yl)carbazol-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole;9-[4-[3-(8-carbazol-9-yldibenzofuran-4-yl)phenyl]dibenzofuran-2-yl]carbazole;9-[6-[3-(6-carbazol-9-yldibenzofuran-4-yl)phenyl]dibenzofuran-2-yl]carbazole
CID 159668391

Frequently Asked Questions

What is the IUPAC name of 10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide?
The IUPAC name of 10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide (CID 140937119) is 10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide.
What is the SMILES notation for 10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide?
The canonical SMILES for 10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide is O=P1(c2ccccc2)c2ccccc2Oc2c(-c3cc(-n4c5ccccc5c5cc(-c6ccccc6)ccc54)cc4c3oc3ccccc34)cccc21.
What is the InChIKey of 10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide?
The InChIKey is FKDLXNLQJNFKCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30NO3P/c50-53(34-16-5-2-6-17-34)45-24-12-11-23-44(45)52-48-37(20-13-25-46(48)53)40-30-33(29-39-36-19-8-10-22-43(36)51-47(39)40)49-41-21-9-7-18-35(41)38-28-32(26-27-42(38)49)31-14-3-1-4-15-31/h1-30H.
What are the key properties of 10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide?
10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide has a molecular weight of 699.75 g/mol, XLogP of 11.76, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-phenyl-4-[2-(3-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenoxaphosphinine 10-oxide is sourced from PubChem (CID 140937119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).