1,2-Bis(dipentafluorophenylphosphino)ethane

Catalog Number	ACM76858941-1
CAS	76858-94-1
Structure
Synonyms	1,2-Ethanediylbis[Bis(Pentafluorophenyl)Phosphine]
IUPAC Name	2-bis(2,3,4,5,6-pentafluorophenyl)phosphanylethyl-bis(2,3,4,5,6-pentafluorophenyl)phosphane
Molecular Weight	758.23
Molecular Formula	C26H4F20P2
InChI	IGLFIYOFKVGEBP-UHFFFAOYSA-N
InChI Key	InChI=1S/C26H4F20P2/c27-3-7(31)15(39)23(16(40)8(3)32)47(24-17(41)9(33)4(28)10(34)18(24)42)1-2-48(25-19(43)11(35)5(29)12(36)20(25)44)26-21(45)13(37)6(30)14(38)22(26)46/h1-2H2
Boiling Point	494.2±45.0 °C(Predicted)
Melting Point	192-195 °C(lit.)
Purity	98%
Appearance	Solid
Isomeric SMILES	C(CP(C1=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F)P(C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F

Q&A

What is the molecular formula of 1,2-Bis(dipentafluorophenylphosphino)ethane?

The molecular formula is C26H4F20P2.

What is the IUPAC name of 1,2-Bis(dipentafluorophenylphosphino)ethane?

The IUPAC name is 2-bis(2,3,4,5,6-pentafluorophenyl)phosphanylethyl-bis(2,3,4,5,6-pentafluorophenyl)phosphane.

What is the CAS number of 1,2-Bis(dipentafluorophenylphosphino)ethane?

The CAS number is 76858-94-1.

What is the molecular weight of 1,2-Bis(dipentafluorophenylphosphino)ethane?

The molecular weight is 758.2 g/mol.

How many hydrogen bond acceptors does 1,2-Bis(dipentafluorophenylphosphino)ethane have?

It has 20 hydrogen bond acceptors.

How many rotatable bonds does 1,2-Bis(dipentafluorophenylphosphino)ethane have?

It has 7 rotatable bonds.

What is the Canonical SMILES of 1,2-Bis(dipentafluorophenylphosphino)ethane?

The Canonical SMILES is C(CP(C1=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F)P(C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F.

What is the XLogP3 value of 1,2-Bis(dipentafluorophenylphosphino)ethane?

The XLogP3 value is 7.9.

How many heavy atoms are present in 1,2-Bis(dipentafluorophenylphosphino)ethane?

There are 48 heavy atoms.

What is the InChIKey of 1,2-Bis(dipentafluorophenylphosphino)ethane?

The InChIKey is IGLFIYOFKVGEBP-UHFFFAOYSA-N.