Name: 2,3,5-Trimethyl-4-hydroxyphenylthiocyanate
SMILES:
Cc1cc(SC#N)c(C)c(C)c1OMolecular Processing
Molecular formula
C10H11NOS
Molecular weight
193.27
Exact mass
193.0561
XLogP
2.89
TPSA
44.02
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
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
0.3
Molar refractivity
53.79
Supplementary Information
Details werden geladen…
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