الاسم: 6-(N,N-bis(2-chloroethyl)amino)-1,4-benzodioxane
SMILES:
ClCCN(CCCl)c1ccc2c(c1)OCCO2Molecular Processing
Molecular formula
C12H15Cl2NO2
Molecular weight
276.16
Exact mass
275.048
XLogP
2.74
TPSA
21.7
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
71.09
Supplementary Information
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