SMILES:
c1ccc2c(c1)NCCO2Molecular Processing
Molecular formula
C8H9NO
Molecular weight
135.17
Exact mass
135.0684
XLogP
1.49
TPSA
21.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
10
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
40.43
Supplementary Information
Details werden geladen…
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