CCCOCCN(CCOCCC)c1ccc(N)cc1F
名称: 2-fluoro-N1,N1-bis(2-propoxyethyl)benzene-1,4-diamine
SMILES: CCCOCCN(CCOCCC)c1ccc(N)cc1F

Molecular Processing

Molecular formula
C16H27FN2O2
Molecular weight
298.4
Exact mass
298.2057
XLogP
3.07
TPSA
47.72
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
11
Heavy atoms
21
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
0.625
Molar refractivity
85.25

Supplementary Information

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