Name: ethyl 1,4-dimethyl-1H-pyrrole-2-acetate
SMILES:
CCOC(=O)Cc1cc(C)cn1CMolecular Processing
Molecular formula
C10H15NO2
Molecular weight
181.23
Exact mass
181.1103
XLogP
1.44
TPSA
31.23
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
50.49
Supplementary Information
Details werden geladen…
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