Cc1cc(CC(=O)OC(C)(C)C)cc(O)c1N
Name: t-butyl 4-amino-3-hydroxy-5-methyl-phenylacetate
SMILES: Cc1cc(CC(=O)OC(C)(C)C)cc(O)c1N

Molecular Processing

Molecular formula
C13H19NO3
Molecular weight
237.3
Exact mass
237.1365
XLogP
2.17
TPSA
72.55
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
66.81

Supplementary Information

Details werden geladen…

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