Product Number: 89487990
CAS Registry Number 89487-99-0
Name:
5-Pyrimidinecarbonitrile, 1,6-dihydro-2-(methylthio)-6-oxo-
5-Pyrimidinecarbonitrile, 1,4-dihydro-2-(methylthio)-4-oxo- (9CI)
5-Pyrimidinecarbonitrile, 4-hydroxy-2-(methylthio)- (6CI,7CI)
4-Hydroxy-2-[methylthio]pyrimidine-5-carbonitrile
4-Hydroxy-2-methylsulfanylpyrimidine-5-carbonitrile
5-Cyano-3,4-dihydro-2-methylthiopyrimidin-4-one
Chemical Formula: C6H5N3OS
Exact Mass: 167.02
Molecular Weight: 167.19
m/z: 167.02 (100.0%), 168.02 (6.6%), 169.01 (4.5%), 168.01 (1.9%)
InChI:InChI=1S/C6H5N3OS/c1-11-6-8-3-4(2-7)5(10)9-6/h3H,1H3,(H,8,9,10)
InChI Key:XTLKENCFQIAAJK-UHFFFAOYSA-N
Canonical SMILES：CSC1=NC=C(C(=O)N1)C#N
| Thermal Properties |
Value |
Condition |
Note |
| Melting Point |
222-224 °C |
Solv: isopropanol (67-63-0) |
(1)CAS |
| Melting Point |
220-224 °C |
Solv: isopropanol (67-63-0) |
(1)CAS |
| Melting Point |
220-223 °C |
Solv: ethanol (64-17-5) |
(2)CAS |
| Melting Point |
220-222 °C |
|
(3)CAS |
| Melting Point |
220-222 °C |
|
(4)CAS |
| Melting Point |
220-222 °C |
Solv: ethanol (64-17-5) |
(5)CAS |
|
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