ChemicalBook--->CAS DataBase List--->73018-10-7

73018-10-7

73018-10-7 Structure

73018-10-7 Structure
IdentificationMore
[Name]

2-MERCAPTOPYRIDINE
[CAS]

73018-10-7
[Synonyms]

2(1H)-PYRIDINETHIONE
2-MERCAPTOPYRIDINE
2-PYRIDINETHIOL
2-PYRIDYL MERCAPTAN
MERCAPTO(2-)PYRIDINE
2-Pyridinethiol(7CI,9CI)
[EINECS(EC#)]

220-131-9
[Molecular Formula]

C5H5NS
[MDL Number]

MFCD00006285
[Molecular Weight]

111.16
[MOL File]

73018-10-7.mol
Chemical PropertiesBack Directory
[Melting point ]

127-130 °C(lit.)
[Boiling point ]

194℃
[density ]

1.166
[Fp ]

71℃
[storage temp. ]

2-8°C
[pka]

2.22±0.43(Predicted)
[InChI]

InChI=1S/C5H5NS/c7-5-3-1-2-4-6-5/h1-4H,(H,6,7)
[InChIKey]

WHMDPDGBKYUEMW-UHFFFAOYSA-N
[SMILES]

C1(S)=NC=CC=C1
[CAS DataBase Reference]

73018-10-7(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[RTECS ]

UT9600000
[F ]

10-23
Hazard InformationBack Directory
[Uses]

Pyridine-2-Thiol (cas# 73018-10-7) is a useful reagent in the preparation of bicalutamide analogues for the potential treatment of prostate cancer.
[Definition]

ChEBI: Pyridine substituted at C-2 by a sulfanyl group.
[Purification Methods]

If impure, dissolve in CHCl3, wash with dilute AcOH, H2O, dry (MgSO4), evaporate under reduced pressure and recrystallise the residue from *C6H6 or H2O. 2-Methylmercaptopyridine (b 100-104o/33mm, pK2 0 3.59) was formed by treatment with MeI/NaOH. [Albert & Barlin J Chem Soc 2394 1959, Phillips & Shapiro J Chem Soc 584 1942, Beilstein 21 H 45, 21 III/IV 373, 21/7 V 147.]
Spectrum DetailBack Directory
[Spectrum Detail]

2-MERCAPTOPYRIDINE(73018-10-7)1HNMR
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