Methyl 2-Chloro-6-(trifluoromethyl)nicotinate - CAS 1073129-57-3
Catalog: |
BB076223 |
Product Name: |
Methyl 2-Chloro-6-(trifluoromethyl)nicotinate |
CAS: |
1073129-57-3 |
Synonyms: |
Methyl 2-Chloro-6-(trifluoromethyl)nicotinate; methyl 2-chloro-6-(trifluoromethyl)pyridine-3-carboxylate; Methyl2-chloro-6-(trifluoromethyl)nicotinate |
IUPAC Name: | methyl 2-chloro-6-(trifluoromethyl)pyridine-3-carboxylate |
Description: | Methyl 2-Chloro-6-(trifluoromethyl)nicotinate (cas# 1073129-57-3) is a useful research chemical. |
Molecular Weight: | 239.58 |
Molecular Formula: | C8H5NO2F3Cl |
Canonical SMILES: | COC(=O)C1=C(N=C(C=C1)C(F)(F)F)Cl |
InChI: | InChI=1S/C8H5ClF3NO2/c1-15-7(14)4-2-3-5(8(10,11)12)13-6(4)9/h2-3H,1H3 |
InChI Key: | OFOKILFDGSZHKO-UHFFFAOYSA-N |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Colourless Oil |
Storage: | 4°C, Inert atmosphere |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 247 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 238.9960906 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 238.9960906 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 39.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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