O=Cc1cccc2nnsc12
Name: 1,2,3-benzothiadiazole-7-carbaldehyde
SMILES: O=Cc1cccc2nnsc12

Molecular Processing

Molecular formula
C7H4N2OS
Molecular weight
164.19
Exact mass
164.0044
XLogP
1.5
TPSA
42.85
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
11
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
42.8

Supplementary Information

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