Name: methyl 3-hydroxy-5-methoxybenzo[b]thiophene-2-carboxylate
SMILES:
COC(=O)c1sc2ccc(OC)cc2c1OMolecular Processing
Molecular formula
C11H10O4S
Molecular weight
238.26
Exact mass
238.03
XLogP
2.4
TPSA
55.76
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
61.38
Supplementary Information
Details werden geladen…
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