Name: 3,7-dimethylbenzo[d]isoxazol-5-amine
SMILES:
Cc1noc2c(C)cc(N)cc12Molecular Processing
Molecular formula
C9H10N2O
Molecular weight
162.19
Exact mass
162.0793
XLogP
2.03
TPSA
52.05
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
47.9
Supplementary Information
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