2-(4-Pyridyl)-4-methylthiazole-5-carboxylic acid - CAS 144060-98-0
Catalog: |
BB009719 |
Product Name: |
2-(4-Pyridyl)-4-methylthiazole-5-carboxylic acid |
CAS: |
144060-98-0 |
Synonyms: |
4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carboxylic acid |
IUPAC Name: | 4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carboxylic acid |
Description: | 2-(4-Pyridyl)-4-methylthiazole-5-carboxylic acid (CAS# 144060-98-0) is a useful research chemical. |
Molecular Weight: | 220.25 |
Molecular Formula: | C10H8N2O2S |
Canonical SMILES: | CC1=C(SC(=N1)C2=CC=NC=C2)C(=O)O |
InChI: | InChI=1S/C10H8N2O2S/c1-6-8(10(13)14)15-9(12-6)7-2-4-11-5-3-7/h2-5H,1H3,(H,13,14) |
InChI Key: | WAIPVXWDQQHMQG-UHFFFAOYSA-N |
Boiling Point: | 467 °C at 760 mmHg |
Density: | 1.381 g/cm3 |
Appearance: | Beige powder |
MDL: | MFCD00171757 |
LogP: | 2.21170 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
Complexity: | 244 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.03064868 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.03064868 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 91.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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