Name: 2,5-diheptylthiophene 1,1-dioxide
SMILES:
CCCCCCCC1=CC=C(CCCCCCC)S1(=O)=OMolecular Processing
Molecular formula
C18H32O2S
Molecular weight
312.52
Exact mass
312.2123
XLogP
5.9
TPSA
34.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
12
Heavy atoms
21
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
91.84
Supplementary Information
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