XPhos Pd G2

Catalog Number	ACM1310584145-1
CAS	1310584-14-5
Structure
Synonyms	Chloro(2-dicyclohexylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl)(2'-amino-1,1'-biphenyl-2-yl) palladium(II)
Molecular Weight	785.79
Molecular Formula	C45H58ClNPPd
Melting Point	202-210 °C
Purity	98%
Appearance	Powder
Application	Palladium precatalyst for Suzuki-Miyaura coupling reactions.

Q&A

What is the molecular formula of XPhos Pd G2?

The molecular formula of XPhos Pd G2 is C45H59ClNPPd.

What is the molecular weight of XPhos Pd G2?

The molecular weight of XPhos Pd G2 is 786.8 g/mol.

What is the IUPAC Name of XPhos Pd G2?

The IUPAC Name of XPhos Pd G2 is chloropalladium(1+);dicyclohexyl-[2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane;2-phenylaniline.

What is the InChI of XPhos Pd G2?

The InChI of XPhos Pd G2 is InChI=1S/C33H49P.C12H10N.ClH.Pd/c1-23(2)26-21-30(24(3)4)33(31(22-26)25(5)6)29-19-13-14-20-32(29)34(27-15-9-7-10-16-27)28-17-11-8-12-18-28;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;;/h13-14,19-25,27-28H,7-12,15-18H2,1-6H3;1-6,8-9H,13H2;1H;/q;-1;;+2/p-1.

What is the InChIKey of XPhos Pd G2?

The InChIKey of XPhos Pd G2 is HLXMDSGYOJBEBA-UHFFFAOYSA-M.

What is the canonical SMILES of XPhos Pd G2?

The canonical SMILES of XPhos Pd G2 is CC(C)C1=CC(=C(C(=C1)C(C)C)C2=CC=CC=C2P(C3CCCCC3)C4CCCCC4)C(C)C.C1=CC=C([C-]=C1)C2=CC=CC=C2N.Cl[Pd+].

What is the hydrogen bond donor count of XPhos Pd G2?

The hydrogen bond donor count of XPhos Pd G2 is 1.

What is the hydrogen bond acceptor count of XPhos Pd G2?

The hydrogen bond acceptor count of XPhos Pd G2 is 2.

What is the rotatable bond count of XPhos Pd G2?

The rotatable bond count of XPhos Pd G2 is 8.

Is XPhos Pd G2 a canonicalized compound?

Yes, XPhos Pd G2 is a canonicalized compound.