4,6-Bis(diphenylphosphino)phenoxazine

Catalog Number	ACM261733180-1
CAS	261733-18-0
Structure
Synonyms	4,6-Bis(diphenylphosphino)-10H-phenoxazine; N-XantPhos
IUPAC Name	(6-diphenylphosphanyl-10H-phenoxazin-4-yl)-diphenylphosphane
Molecular Weight	551.55
Molecular Formula	C36H27NOP2
InChI	HSWZLYXRAOXOLL-UHFFFAOYSA-N
InChI Key	InChI=1S/C36H27NOP2/c1-5-15-27(16-6-1)39(28-17-7-2-8-18-28)33-25-13-23-31-35(33)38-36-32(37-31)24-14-26-34(36)40(29-19-9-3-10-20-29)30-21-11-4-12-22-30/h1-26,37H
Boiling Point	662.1±55.0 °C(Predicted)
Melting Point	256-262 °C
Purity	98%
Appearance	Solid
Isomeric SMILES	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC4=C3OC5=C(N4)C=CC=C5P(C6=CC=CC=C6)C7=CC=CC=C7
pKa	1.34±0.20(Predicted)

Q&A

What are some of the depositor-supplied synonyms for 4,6-Bis(diphenylphosphino)phenoxazine?

Some depositor-supplied synonyms for 4,6-Bis(diphenylphosphino)phenoxazine include NIXANTPHOS, NiXanthphos, and (6-diphenylphosphanyl-10H-phenoxazin-4-yl)-diphenyl-phosphane.

How many hydrogen bond acceptor counts does 4,6-Bis(diphenylphosphino)phenoxazine have?

4,6-Bis(diphenylphosphino)phenoxazine has 2 hydrogen bond acceptor counts.

What is the exact mass of 4,6-Bis(diphenylphosphino)phenoxazine?

The exact mass of 4,6-Bis(diphenylphosphino)phenoxazine is 551.15678848.

What is the molecular formula of 4,6-Bis(diphenylphosphino)phenoxazine?

The molecular formula of 4,6-Bis(diphenylphosphino)phenoxazine is C36H27NOP2.

How many rotatable bond counts does 4,6-Bis(diphenylphosphino)phenoxazine have?

4,6-Bis(diphenylphosphino)phenoxazine has 6 rotatable bond counts.

What is the IUPAC name of 4,6-Bis(diphenylphosphino)phenoxazine?

The IUPAC name of 4,6-Bis(diphenylphosphino)phenoxazine is (6-diphenylphosphanyl-10H-phenoxazin-4-yl)-diphenylphosphane.

What is the Canonical SMILES representation of 4,6-Bis(diphenylphosphino)phenoxazine?

The Canonical SMILES representation of 4,6-Bis(diphenylphosphino)phenoxazine is C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC4=C3OC5=C(N4)C=CC=C5P(C6=CC=CC=C6)C7=CC=CC=C7.

How many heavy atom counts does 4,6-Bis(diphenylphosphino)phenoxazine have?

4,6-Bis(diphenylphosphino)phenoxazine has 40 heavy atom counts.

What is the XLogP3 value of 4,6-Bis(diphenylphosphino)phenoxazine?

The XLogP3 value of 4,6-Bis(diphenylphosphino)phenoxazine is 8.4.