2'-Dicyclohexylphosphino-2,6-dimethoxy-3-sulfonato-1,1'-biphenyl hydrate sodium salt

C26H36NaO6PSCAS 1049726-96-6530.59 g/mol

Open in Covalent MOL file
OSOOO−OPH2ONa+
EtherPhosphineSulfonic acid

Properties

Molecular formula
C26H36NaO6PS
Molar mass
530.59 g/mol
Exact mass
530.1868 Da
logP
2.23Crippen estimate
Polar surface area
107.2 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
7

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
1049726-96-6
SMILES
COC1=C(C(=C(C=C1)S(=O)(=O)[O-])OC)C2=CC=CC=C2P(C3CCCCC3)C4CCCCC4.O.[Na+]
InChIKey
MAPQBSXKBDVINV-UHFFFAOYSA-M
InChI
InChI=1S/C26H35O5PS.Na.H2O/c1-30-22-17-18-24(33(27,28)29)26(31-2)25(22)21-15-9-10-16-23(21)32(19-11-5-3-6-12-19)20-13-7-4-8-14-20;;/h9-10,15-20H,3-8,11-14H2,1-2H3,(H,27,28,29);;1H2/q;+1;/p-1

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Work with 2'-Dicyclohexylphosphino-2,6-dimethoxy-3-sulfonato-1,1'-biphenyl hydrate sodium salt

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Similar compounds

2'-Dicyclohexylphosphino-2,6-di-I-propyl-4-sulfonato-1,1'-biphenylhydratesodiumsalt870245-84-458 % similar 2-Dicyclohexylphosphino-2',6'-dimethoxybiphenyl657408-07-655 % similar 2-(Dicyclohexylphosphino)-2'-methoxybiphenyl255835-82-649 % similar [2′-(Amino-κN)[1,1′-biphenyl]-2-yl-κC][dicyclohexyl(2′,6′-dimethoxy[1,1′-biphenyl]-2-yl)phosphine-κP](methanesulfonato-κO)palladium1445085-82-446 % similar [2',4'-Bis(1,1-dimethylethyl)-6'-methoxy[1,1'-biphenyl]-2-yl]dicyclohexylphosphine1848244-75-644 % similar (SP-4-3)-[Dicyclohexyl(2′,6′-dimethoxy[1,1′-biphenyl]-2-yl)phosphine-κP](methanesulfonato-κO)[2′-(methylamino-κN)[1,1′-biphenyl]-2-yl-κC]palladium1599466-87-144 % similar [2′,6′-Bis(1-methylethoxy)[1,1′-biphenyl]-2-yl]dicyclohexylphosphine787618-22-843 % similar (SP-4-4)-[2-[2-(Amino-κN)ethyl]phenyl-κC]chloro[dicyclohexyl(2′,6′-dimethoxy[1,1′-biphenyl]-2-yl)phosphine-κP]palladium1028206-58-740 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

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