C1=CNC=CC1=S
CAS: 4556-23-4
Name: 1H-pyridine-4-thione
SMILES: C1=CNC=CC1=S

Molecular Processing

Molecular formula
C5H5NS
Molecular weight
111.17
Exact mass
111.0143
XLogP
1.74
TPSA
15.79
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
7
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0
Molar refractivity
31.63

Supplementary Information

InChIKey: FHTDDANQIMVWKZ-UHFFFAOYSA-N
Synonyms
4-Mercaptopyridine4556-23-44-PYRIDINETHIOL4-Thiopyridine4-ThiopyridoneNSC-76036ZH8DP7EE6V4-PS cpdRefChem:527016224-926-1Pyridine-4-thiolPyridine-4(1H)-thione19829-29-94(1H)-Pyridinethione1H-pyridine-4-thionePyridine, 4-mercapto-MFCD000064224-PyridinethioneNSC760365-21-07-00167 (Beilstein Handbook Reference)EINECS 224-926-1NSC 76036BRN 0105392BRN 01058694-Pyridinethiol; 4-Thiopyridine; 4-Sulfanylpyridine; NSC 760364mercaptopyridine4-mercapto pyridine4-mercapto-pyridine4-Pyridyl Mercaptan4-Mercaptopyridine, 95%
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Involved in 209 reactions→

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