Methyl 5-(Methylsulfonyl)pyridine-2-carboxylate - CAS 1201326-81-9
Catalog: |
BB004724 |
Product Name: |
Methyl 5-(Methylsulfonyl)pyridine-2-carboxylate |
CAS: |
1201326-81-9 |
Synonyms: |
5-methylsulfonyl-2-pyridinecarboxylic acid methyl ester; methyl 5-methylsulfonylpyridine-2-carboxylate |
IUPAC Name: | methyl 5-methylsulfonylpyridine-2-carboxylate |
Description: | Methyl 5-(Methylsulfonyl)pyridine-2-carboxylate (CAS# 1201326-81-9) is a useful research chemical. |
Molecular Weight: | 215.23 |
Molecular Formula: | C8H9NO4S |
Canonical SMILES: | COC(=O)C1=NC=C(C=C1)S(=O)(=O)C |
InChI: | InChI=1S/C8H9NO4S/c1-13-8(10)7-4-3-6(5-9-7)14(2,11)12/h3-5H,1-2H3 |
InChI Key: | OANIRYJPNCZNHW-UHFFFAOYSA-N |
Storage: | Sealed in dry, Room Temperature |
LogP: | 1.35250 |
Publication Number | Title | Priority Date |
CN-112979655-A | Triazolopyridazine derivative, preparation method, pharmaceutical composition and application thereof | 20191216 |
WO-2021121294-A1 | Triazolopyridazine derivative, preparation method therefor, pharmaceutical composition thereof, and use thereof | 20191216 |
CN-110943253-A | High-voltage lithium ion battery combined electrolyte additive, electrolyte and battery thereof | 20191024 |
CA-2820800-A1 | Triazole derivatives as wnt signaling pathway inhibitors | 20101208 |
CN-103429583-A | Triazole derivatives as WNT signaling pathway inhibitors | 20101208 |
Complexity: | 306 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.02522894 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.02522894 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 81.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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