Nombre: 2-(chloromethyl)-6-cyclopentylsulfanylpyridine
SMILES:
C1CCC(C1)SC2=CC=CC(=N2)CClMolecular Processing
Molecular formula
C11H14ClNS
Molecular weight
227.76
Exact mass
227.0535
XLogP
3.86
TPSA
12.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.545
Molar refractivity
61.91
Supplementary Information
InChIKey: IIDBAUGPTDCEGV-UHFFFAOYSA-N
Sinónimos
SCHEMBL15668901IIDBAUGPTDCEGV-UHFFFAOYSA-N2-Chloromethyl-6-cyclopentylsulfanyl-pyridine
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