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2-(Methylsulfanyl)-1-(4-Pyridinyl)Ethanone
[CAS# 208264-95-3]

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Achemica Switzerland Inquire  
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Chemical manufacturer since 2002
Identification
Name 2-(Methylsulfanyl)-1-(4-Pyridinyl)Ethanone
Synonyms 2-(Methylthio)-1-(4-pyridinyl)ethanone; 2-Methylsulfanyl-1-pyridin-4-yl-ethanone
Molecular Structure CAS#: 208264-95-3, 2-(Methylsulfanyl)-1-(4-Pyridinyl)Ethanone
Molecular Formula C8H9NOS
Molecular Weight 167.23
CAS Registry Number 208264-95-3
SMILES CSCC(=O)C1=CC=NC=C1
InChI 1S/C8H9NOS/c1-11-6-8(10)7-2-4-9-5-3-7/h2-5H,6H2,1H3
InChIKey GNBPAYQJFADJDZ-UHFFFAOYSA-N
Properties
Density 1.2±0.1g/cm3 (Cal.)
Boiling point 297.5±20.0°C at 760 mmHg (Cal.)
Flash point 133.8±21.8°C (Cal.)
Refractive index 1.563 (Cal.)
References
(1) Philip Prathipati, Ngai Ling Ma* and Thomas H. Keller. Global Bayesian Models for the Prioritization of Antitubercular Agents, J. Chem. Inf. Model., 2008, 48 (12), pp 2362–2370
Market Analysis Reports
List of Reports Available for 2-(Methylsulfanyl)-1-(4-Pyridinyl)Ethanone
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