Structure

CPhos

CAS
1160556-64-8
Catalog Number
ACM1160556648
Category
Organic Phosphine Compounds
Molecular Weight
436.624g/mol
Molecular Formula
C28H41N2P;

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Specification

Synonyms
CPhos; Y-200010; 2-Dicyclohexylphosphino-2',6'-bis(N,N-dimethylamino)biphenyl; 1160556-64-8; SCHEMBL14736169; 2-(2-dicyclohexylphosphanylphenyl)-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine; [1,1'-Biphenyl]-2,6-diamine, 2'-(dicyclohexylphosphino)-N2,N2,N6,N6-tetramethyl-; 2,6-Bis(dimethylamino)-2'-(dicyclohexylphosphino)biphenyl; 2'-(Dicyclohexylphosphino)-2,6-di(dimethylamino)biphenyl;
IUPAC Name
2-(2-dicyclohexylphosphanylphenyl)-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;
Canonical SMILES
CN(C)C1=C(C(=CC=C1)N(C)C)C2=CC=CC=C2P(C3CCCCC3)C4CCCCC4;
InChI
InChI=1S/C28H41N2P/c1-29(2)25-19-13-20-26(30(3)4)28(25)24-18-11-12-21-27(24)31(22-14-7-5-8-15-22)23-16-9-6-10-17-23/h11-13,18-23H,5-10,14-17H2,1-4H3;
InChI Key
DRNAQRXLOSUHBQ-UHFFFAOYSA-N;
Application
Preparation of aryl sulfonamides via palladium-catalyzed chlorosulfonylation of arylboronic acids.
Complexity
489
Covalently-Bonded Unit Count
1
Exact Mass
436.301g/mol
H-Bond Acceptor
2
Heavy Atom Count
31
Monoisotopic Mass
436.301g/mol
Rotatable Bond Count
6
Topological Polar Surface Area
6.5A^2
What is the molecular formula of CPhos?

The molecular formula of CPhos is C28H41N2P.

When was CPhos first created in the database?

CPhos was first created in the database on August 24, 2009.

What is the molecular weight of CPhos?

The molecular weight of CPhos is 436.6 g/mol.

What are some synonyms of CPhos?

Some synonyms of CPhos include 2-Dicyclohexylphosphino-2',6'-bis(N,N-dimethylamino)biphenyl and 2'-(Dicyclohexylphosphino)-N2,N2,N6,N6-tetramethyl-[1,1'-biphenyl]-2,6-diamine.

What is the InChIKey of CPhos?

The InChIKey of CPhos is DRNAQRXLOSUHBQ-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does CPhos have?

CPhos has 2 hydrogen bond acceptor counts.

What is the topological polar surface area of CPhos?

The topological polar surface area of CPhos is 6.5?2.

How many rotatable bond counts does CPhos have?

CPhos has 6 rotatable bond counts.

What is the formal charge of CPhos?

The formal charge of CPhos is 0.

How many defined atom stereocenter counts does CPhos have?

CPhos has 0 defined atom stereocenter counts.

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