| Weight | 170.193 g/mol |
|---|---|
| Formula | C6H6N2O2S |
| Hydrogen Acceptors | 4 |
| Hydrogen Donors | 1 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 2 |
2-(methylthio)pyrimidine-5-carboxylic acid (110099-94-0)
2-(methylthio)-5-pyrimidinecarboxylic acid · 110099-94-0
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- Sigma-Aldrich - Search for 2-(methylthio)pyrimidine-5-carboxylic acid
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- TCI - Search for 2-(methylthio)pyrimidine-5-carboxylic acid
- Triorganotin(IV) derivatives of 7-amino-2-(methylthio)[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid. Synthesis, spectroscopic characterization, in vitro antimicrobial activity and X-ray crystallography (Journal of Organometallic Chemistry, 2010)
- Synthetic studies on novel 1,4-dihydro-2-methylthio-4,4,6-trisubstituted pyrimidine-5-carboxylic acid esters and their tautomers. (Chemical & Pharmaceutical Bulletin, 2011)
- ChemInform Abstract: Synthetic Studies on Novel 1,4-Dihydro-2-methylthio-4,4,6-trisubstituted Pyrimidine-5-carboxylic Acid Esters and Their Tautomers. (ChemInform, 2012)
- Incorporation of Pt(II) complex with [amino-2(methylthio)(1,2,4)triazole-(1,5-a)pyrimidine-6-carboxylic-acid] ligand in MCM41 for controlled release (2015)
- Allergic contact dermatitis from 4-chloro-2-[methylthio]pyrimidine-5-carboxylic acid ethyl ester and methyl 4-hydroxy-2-hexynoate in a laboratory chemist. (Contact Dermatitis, 2008)
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Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 2-(methylthio)-5-pyrimidinecarboxylic acid
- 110099-94-0
-
SMILESCSC1=NC=C(C=N1)C(=O)O
-
InChIKeyBIJIAHGQTQWGJB-UHFFFAOYSA-N
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Alternate Names
Estimated Properties
| Boiling Point | 275.75 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 323.23 C | EPI Suite |
| Density | 1.35 g/cm3 | EPA T.E.S.T. |
| Flash Point | 128.51 C | EPA T.E.S.T. |
| Melting Point | 112.31 C | EPI Suite |
| Water Solubility | 9889.63 mg/L | EPA T.E.S.T. |
| Water Solubility | 3258.3 mg/L | EPI Suite |
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