이름: PhCH2COOH PyBOP
SMILES:
F[P-](F)(F)(F)(F)F.O=C(O)Cc1ccccc1.c1ccc2c(c1)nnn2O[P+](N1CCCC1)(N1CCCC1)N1CCCC1Molecular Processing
Molecular formula
C26H36F6N6O3P2
Molecular weight
656.55
Exact mass
656.2228
XLogP
7.52
TPSA
86.96
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
43
Rings
6
Aromatic rings
3
Saturated rings
3
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
17
Covalent units
3
Fraction Csp3
0.5
Molar refractivity
154.8
Supplementary Information
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