CC1=C(C#N)C(=C(C#N)C#N)OC1(C)C(F)(F)F
名称: 2-(3-cyano-4,5-dimethyl-5-trifluoromethyl-2(5H)-furanylidene)propanedinitrile
SMILES: CC1=C(C#N)C(=C(C#N)C#N)OC1(C)C(F)(F)F

Molecular Processing

Molecular formula
C11H6F3N3O
Molecular weight
253.18
Exact mass
253.0463
XLogP
2.48
TPSA
80.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
18
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
52.11

Supplementary Information

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