الاسم: 2-Chloro-α,α,α-trifluoro-p-tolyl-3-(1-carbethoxyethoxy)-4-nitrophenyl ether
SMILES:
CCOC(=O)C(C)OC1C(Cl)=C(OC2=C(Cl)C(OC(C)C(=O)OCC)C(c3ccccc3C(F)(F)F)([N+](=O)[O-])C=C2)C=CC1(c1ccccc1C(F)(F)F)[N+](=O)[O-]Molecular Processing
Molecular formula
C36H32Cl2F6N2O11
Molecular weight
853.55
Exact mass
852.1287
XLogP
8.1
TPSA
166.57
H-bond donors
0
H-bond acceptors
11
Rotatable bonds
14
Heavy atoms
57
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
6
Undefined stereo
6
Formal charge
0
Heteroatoms
21
Covalent units
1
Fraction Csp3
0.389
Molar refractivity
187.29
Supplementary Information
جارٍ جلب التفاصيل…
مشارك في 30 تفاعل→