CAS
69390-09-6 Purity
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69390-09-6 Purity
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5-Methoxy-2-sulfanylidene-1H-pyrimidin-4-one
CAS
6939-11-3
Catalog Number
ACM6939113
Category
Other Products
Molecular Weight
158.18
Molecular Formula
C5H6N2O2S
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- Product Description
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Specification
Synonyms
NSC56778, 5-methoxy-2-sulfanyl-4-pyrimidinol, 3J-355S, CID2763759, AE-641/00430003, 6939-11-3
IUPAC Name
5-methoxy-2-sulfanylidene-1H-pyrimidin-4-one
Canonical SMILES
COC1=CNC(=S)NC1=O
InChI Key
CDFYFTSELDPCJA-UHFFFAOYSA-N
Boiling Point
348.4ºC at 760 mmHg
Melting Point
255-266ºC
Flash Point
164.5ºC
Density
1.43g/cm³
Exact Mass
158.01500
H-Bond Acceptor
2
H-Bond Donor
2
Upstream Synthesis Route 1
- 3938-96-3
- 17356-08-0
- 6939-11-3
Reference: [1]Chemistry and industry,1956,p. 1453
Downstream Synthesis Route 1
- 6939-11-3
- 31458-33-0
Reference: [1] Chemistry and Industry (London, United Kingdom), 1956, p. 1453
Downstream Synthesis Route 2
- 6939-11-3
- 695-87-4
Reference: [1] Patent: WO2003/87067, 2003, A1, . Location in patent: Page/Page column 36-37
Downstream Synthesis Route 3
- 6939-11-3
- 695-87-4
Reference: [1] Chemistry and Industry (London, United Kingdom), 1956, p. 1453
[2] Journal of the Chemical Society, 1960, p. 4590,4594
Downstream Synthesis Route 4
- 75-77-4
- 6939-11-3
- 34293-70-4
Reference: [1]Zeitschrift fur Naturforschung, B: Chemical Sciences,1987,vol. 42,p. 355 - 359
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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