Name: Benzalkonium chloride
SMILES:
CCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1.[Cl-]Molecular Processing
Molecular formula
C22H40ClN
Molecular weight
354.02
Exact mass
353.2849
XLogP
3.58
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
14
Heavy atoms
24
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
2
Fraction Csp3
0.727
Molar refractivity
103.58
Supplementary Information
Details werden geladen…
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