| Weight | 171.583 g/mol |
|---|---|
| Formula | C7H6ClNO2 |
| Hydrogen Acceptors | 3 |
| Hydrogen Donors | 0 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 1 |
Methyl 2-chloronicotinate (40134-18-7)
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- MOLECULAR STRUCTURE, FTIR, FT-RAMAN, NBO ANALYSIS, FIRST ORDER HYPERPOLARIZABILITIES, THERMODYNAMIC FUNCTIONS AND NMR CHEMICAL SHIELDING ANISOTROPY (CSA) PARAMETERS OF METHYL 2-CHLORONICOTINATE BY AB INITIO DFT CALCULATIONS. (International Journal of Approximate Reasoning, 2016)
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Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. -
SMILESCOC(=O)C1=C(N=CC=C1)Cl
-
InChIKeyMYGAJZBZLONIBZ-UHFFFAOYSA-N
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Similar Compounds
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ethyl 4-amino-6-chloronicotinate
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methyl 6-hydroxynicotinate
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methyl 6-chloro-5-cyano-2-methylnicotinate
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methyl 2-cyanonicotinate
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ethyl 4-chloro-6-fluoroquinoline-3-carboxylate
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Methyl 2-chloronicotinate
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