Название: 4-amino-2-chloro-3-methylphenyl thiocyanate
SMILES:
Cc1c(N)ccc(SC#N)c1ClMolecular Processing
Molecular formula
C8H7ClN2S
Molecular weight
198.68
Exact mass
198.0018
XLogP
2.8
TPSA
49.81
H-bond donors
1
H-bond acceptors
3
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
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
52.07
Supplementary Information
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