CSC1=C(N=CC=C1)C=O
CAS: 405175-06-6
Nom: 3-methylsulfanylpyridine-2-carbaldehyde
SMILES: CSC1=C(N=CC=C1)C=O

Molecular Processing

Molecular formula
C7H7NOS
Molecular weight
153.21
Exact mass
153.0248
XLogP
1.62
TPSA
29.96
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
10
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
0.143
Molar refractivity
41.41

Supplementary Information

InChIKey: JIYCYYVLGCRZSH-UHFFFAOYSA-N
Synonymes
3-(Methylthio)picolinaldehyde405175-06-6SCHEMBL946861SCHEMBL4070222JIYCYYVLGCRZSH-UHFFFAOYSA-N3-methylsulfanyl-pyridine-2-carbaldehydeDB-2710242-PYRIDINECARBOXALDEHYDE, 3-(METHYLTHIO)-
Voir la source →
Impliqué dans 8 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→