COC1=CC(=CC=C1)S(=O)(=O)C2=CC=CC(=C2C#N)F
الاسم: 2-fluoro-6-(3-methoxyphenyl)sulfonylbenzonitrile
SMILES: COC1=CC(=CC=C1)S(=O)(=O)C2=CC=CC(=C2C#N)F

Molecular Processing

Molecular formula
C14H10FNO3S
Molecular weight
291.3
Exact mass
291.0365
XLogP
2.54
TPSA
67.16
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
69.56

Supplementary Information

InChIKey: MSGFCYJYWWHMFD-UHFFFAOYSA-N
مرادفات
SCHEMBL8410402MSGFCYJYWWHMFD-UHFFFAOYSA-N2-Fluoro-6-[(3 -methoxyphenyl)sulfonyl]benzonitrile
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