Nombre: 2-(4-bromo-thiophen-2-yl)tetrahydro-furan-3-carbonitrile
SMILES:
N#CC1CCOC1c1cc(Br)cs1Molecular Processing
Molecular formula
C9H8BrNOS
Molecular weight
258.14
Exact mass
256.951
XLogP
3.11
TPSA
33.02
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
54.43
Supplementary Information
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