2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl

Catalog Number	ACM564483198-1
CAS	564483-19-8
Structure
Synonyms	t-Bu XPhos; 2-Di-tert-butylphosphino-2',4',6'-triisopropylbiphenyl
IUPAC Name	ditert-butyl-[2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane
Molecular Weight	424.64
Molecular Formula	C29H45P
InChI	SACNIGZYDTUHKB-UHFFFAOYSA-N
InChI Key	InChI=1S/C29H45P/c1-19(2)22-17-24(20(3)4)27(25(18-22)21(5)6)23-15-13-14-16-26(23)30(28(7,8)9)29(10,11)12/h13-21H,1-12H3
Boiling Point	493.5±45.0 °C(Predicted)
Melting Point	148-151 °C(lit.)
Purity	98%
Appearance	Solid
Common Name	tBuXPhos
Isomeric SMILES	CC(C)C1=CC(=C(C(=C1)C(C)C)C2=CC=CC=C2P(C(C)(C)C)C(C)(C)C)C(C)C
Type	Buchwald Ligands

Q&A

What is the CAS number of 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl?

The CAS number of 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl is 564483-19-8.

What is the Canonical SMILES of 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl?

The Canonical SMILES of 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl is CC(C)C1=CC(=C(C(=C1)C(C)C)C2=CC=CC=C2P(C(C)(C)C)C(C)(C)C)C(C)C.

What is the XLogP3 value of 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl?

The XLogP3 value of 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl is 8.5.

How many topological polar surface area does 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl have?

2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl has a topological polar surface area of 0.

What is the molecular formula of 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl?

The molecular formula of 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl is C29H45P.

What is the InChIKey of 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl?

The InChIKey of 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl is SACNIGZYDTUHKB-UHFFFAOYSA-N.

How many heavy atoms does 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl contain?

2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl contains 30 heavy atoms.

What is the Computed Properties Rotatable Bond Count of 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl?

The Computed Properties Rotatable Bond Count of 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl is 7.

how many Hydrogen Bond Acceptor Count does 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl contain?

2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl contains 0 Hydrogen Bond Acceptor Count.

What are some of the depositor-supplied synonyms for 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl?

Some of the depositor-supplied synonyms for 2-Di-t-butylphosphino-2',4',6'-tri-i-propyl-1,1'-biphenyl are tBuXPhos, tert-Butyl XPhos, and 2-di-tert-butylphosphino-2',4',6'-triisopropylbiphenyl.