CC(Br)c1ccc(C(Cl)(Cl)Cl)nc1
Name: 5-(1-bromoethyl)-2-(trichloromethyl)pyridine
SMILES: CC(Br)c1ccc(C(Cl)(Cl)Cl)nc1

Molecular Processing

Molecular formula
C8H7BrCl3N
Molecular weight
303.41
Exact mass
300.8827
XLogP
4.36
TPSA
12.89
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
60.82

Supplementary Information

Details werden geladen…

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