Structure

2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan

CAS
911397-27-8
Catalog Number
ACM911397278-2
Category
Thermally Activated Delayed Fluorescence (TADF) OLED
Molecular Weight
568.549
Molecular Formula
C36H26O3P2

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Specification

Synonyms
911397-27-8;Dibenzo[b,d]furan-2,8-diylbis(diphenylphosphineoxide);Phosphineoxide,1,1-(2,8-ibenzofurandiyl)is[1,1-iphenyl-;SCHEMBL9927366;2,8-Bis(diphenylphosphinyl)dibenzofuran;
IUPAC Name
2,8-bis(diphenylphosphoryl)dibenzofuran;
Canonical SMILES
C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC4=C(C=C3)OC5=C4C=C(C=C5)P(=O)(C6=CC=CC=C6)C7=CC=CC=C7;
InChI
InChI=1S/C36H26O3P2/c37-40(27-13-5-1-6-14-27,28-15-7-2-8-16-28)31-21-23-35-33(25-31)34-26-32(22-24-36(34)39-35)41(38,29-17-9-3-10-18-29)30-19-11-4-12-20-30/h1-26H;
InChI Key
AIAJGVRFXREWPK-UHFFFAOYSA-N;
Boiling Point
252 °C
Melting Point
805.2 ± 60.0 °C
Complexity
836
Covalently-Bonded Unit Count
1
Exact Mass
568.136g/mol
H-Bond Acceptor
3
Heavy Atom Count
41
Monoisotopic Mass
568.136g/mol
Rotatable Bond Count
6
Topological Polar Surface Area
47.3A^2
What is the molecular formula of 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan?

The molecular formula of 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan is C36H26O3P2.

What is the synonym for 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan?

One of the synonyms for 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan is Dibenzo[b,d]furan-2,8-diylbis(diphenylphosphine oxide).

When was 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan created?

2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan was created on February 13, 2015.

What is the IUPAC name of 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan?

The IUPAC name of 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan is 2,8-bis(diphenylphosphoryl)dibenzofuran.

What is the InChI of 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan?

The InChI of 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan is InChI=1S/C36H26O3P2/c37-40(27-13-5-1-6-14-27,28-15-7-2-8-16-28)31-21-23-35-33(25-31)34-26-32(22-24-36(34)39-35)41(38,29-17-9-3-10-18-29)30-19-11-4-12-20-30/h1-26H.

What is the InChIKey of 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan?

The InChIKey of 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan is AIAJGVRFXREWPK-UHFFFAOYSA-N.

What is the canonical SMILES representation of 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan?

The canonical SMILES representation of 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan is C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC4=C(C=C3)OC5=C4C=C(C=C5)P(=O)(C6=CC=CC=C6)C7=CC=CC=C7.

What is the molecular weight of 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan?

The molecular weight of 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan is 568.5 g/mol.

How many hydrogen bond donor counts does 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan have?

2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan has 0 hydrogen bond donor counts.

How many rotatable bond counts does 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan have?

2,8-Bis(diphenylphosphoryl)dibenzo[b,d]furan has 6 rotatable bond counts.

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