chempirical

Di-tert-butyl(2',4',6'-tris(propan-2-yl)-(1,1'-biphenyl)-2-yl)phosphane

C29H45PCAS 564483-19-8424.65 g/mol

Open in Covalent MOL file
P
Phosphine

Properties

Molecular formula
C29H45P
Molar mass
424.65 g/mol
Exact mass
424.3259 Da
logP
9.43Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
5

Hazards

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

Identifiers

CAS number
564483-19-8
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
InChIKey
SACNIGZYDTUHKB-UHFFFAOYSA-N
InChI
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

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Names and synonyms

1 names
  • 2-Di-tert-butylphosphino-2',4',6'-triisopropylbiphenyl

Work with Di-tert-butyl(2',4',6'-tris(propan-2-yl)-(1,1'-biphenyl)-2-yl)phosphane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Diphenyl(2',4',6'-tris(1-methylethyl)(1,1'-biphenyl)-2-yl)-phosphine819867-23-763 % similar Tbuxphos pd G11142811-12-860 % similar Xphos564483-18-758 % similar Tbuxphos-pd-G31447963-75-856 % similar (SP-4-3)-[Bis(1,1-dimethylethyl)[2′,4′,6′-tris(1-methylethyl)[1,1′-biphenyl]-2-yl]phosphine](methanesulfonato-κO)[2′-(methylamino-κN)[1,1′-biphenyl]-2-yl-κC]palladium1599466-89-352 % similar 2-Di-tert-butylphosphino-3,4,5,6-tetram&857356-94-651 % similar 2-(Di-T-butylphosphino)-3-methoxy-6-methyl-2',4',6'-tri-I-propyl-1,1'-biphenyl1262046-34-349 % similar Di-tert-butyl((2',6'-dimethoxy-(1,1'-biphenyl)-2-yl))phosphane819867-21-549 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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