Name: 2-methoxycarbonylbenzyltriphenylphosphonium bromide
SMILES:
COC(=O)c1ccccc1C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[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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