N#CC(=O)c1cc(Cl)cc(Cl)c1Cl
이름: 2,3,5-trichlorobenzoyl cyanide
SMILES: N#CC(=O)c1cc(Cl)cc(Cl)c1Cl

Molecular Processing

Molecular formula
C8H2Cl3NO
Molecular weight
234.47
Exact mass
232.9202
XLogP
3.35
TPSA
40.86
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
51.42

Supplementary Information

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