Name: 2-methylsulfonyl-pyrimidine-4-carbonyl chloride
SMILES:
CS(=O)(=O)c1nccc(C(=O)Cl)n1Molecular Processing
Molecular formula
C6H5ClN2O3S
Molecular weight
220.64
Exact mass
219.9709
XLogP
0.26
TPSA
76.99
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
45.33
Supplementary Information
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Involved in 18 reactions→