chempirical

2-(Di-tert-butylphosphino)-2′-methyl-1,1′-biphenyl

C21H29PCAS 255837-19-5312.44 g/mol

Open in Covalent MOL file
P
Phosphine

Properties

Molecular formula
C21H29P
Molar mass
312.44 g/mol
Exact mass
312.2007 Da
Melting point
91–92 °C
logP
6.37Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

Identifiers

CAS number
255837-19-5
SMILES
Cc1ccccc1-c1ccccc1P(C(C)(C)C)C(C)(C)C
InChIKey
UJONYAVMBYXBJQ-UHFFFAOYSA-N
InChI
InChI=1S/C21H29P/c1-16-12-8-9-13-17(16)18-14-10-11-15-19(18)22(20(2,3)4)21(5,6)7/h8-15H,1-7H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names
  • Phosphine, bis(1,1-dimethylethyl)(2′-methyl[1,1′-biphenyl]-2-yl)-
  • Bis(1,1-dimethylethyl)(2′-methyl[1,1′-biphenyl]-2-yl)phosphine
  • 2-Di-t-butylphosphino-2′-methylbiphenyl

Work with 2-(Di-tert-butylphosphino)-2′-methyl-1,1′-biphenyl

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

2-(Di-tert-butylphosphino)biphenyl224311-51-761 % similar 2′-[Bis(1,1-dimethylethyl)phosphino]-N,N-dimethyl[1,1′-biphenyl]-2-amine224311-49-357 % similar 2-(Dicyclohexylphosphino)-2′-methylbiphenyl251320-86-247 % similar Tris(O-tolyl)phosphine6163-58-243 % similar 2-Methylbiphenyl643-58-342 % similar tert-Butyldiphenylphosphine6002-34-238 % similar O-Xylene95-47-637 % similar (1S)-1-[Bis(1,1-dimethylethyl)phosphino]-2-[(1S)-1-[bis(2-methylphenyl)phosphino]ethyl]ferrocene849924-77-237 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook