Ethyl 4-amino-3,5,6-trichloropicolinate - CAS 91867-42-4
Catalog: |
BB065899 |
Product Name: |
Ethyl 4-amino-3,5,6-trichloropicolinate |
CAS: |
91867-42-4 |
Synonyms: |
ETHYL 4-AMINO-3,5,6-TRICHLOROPICOLINATE; ethyl 4-amino-3,5,6-trichloropyridine-2-carboxylate; ethyl 4-amino-3,5,6-trichloro-2-pyridinecarboxylate; Picloram, ethyl ester |
IUPAC Name: | ethyl 4-amino-3,5,6-trichloropyridine-2-carboxylate |
Description: | Ethyl 4-amino-3,5,6-trichloropicolinate |
Molecular Weight: | 269.51 |
Molecular Formula: | C8H7Cl3N2O2 |
Canonical SMILES: | CCOC(=O)C1=NC(=C(C(=C1Cl)N)Cl)Cl |
InChI: | InChI=1S/C8H7Cl3N2O2/c1-2-15-8(14)6-3(9)5(12)4(10)7(11)13-6/h2H2,1H3,(H2,12,13) |
InChI Key: | NXGNYAVXQNLQRL-UHFFFAOYSA-N |
Complexity: | 242 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 267.957311 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 267.957311 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 65.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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