Name: 3-methoxycarbonyl-benzyl-triphenylphosphonium bromide
SMILES:
COC(=O)c1cccc(C[P+](c2ccccc2)(c2ccccc2)c2ccccc2)c1.[Br-]Molecular Processing
Molecular formula
C27H24BrO2P
Molecular weight
491.37
Exact mass
490.0697
XLogP
1.97
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.074
Molar refractivity
126.63
Supplementary Information
Details werden geladen…
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