CNC(=O)c1ccc(C)c(I)c1
名称: 3-Iodo-N, 4-dimethylbenzamide
SMILES: CNC(=O)c1ccc(C)c(I)c1

Molecular Processing

Molecular formula
C9H10INO
Molecular weight
275.09
Exact mass
274.9807
XLogP
1.96
TPSA
29.1
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
57.29

Supplementary Information

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