ethyl 2-methyl-1,6-naphthyridine-3-carboxylate - CAS 52816-67-8
Catalog: |
BB055990 |
Product Name: |
ethyl 2-methyl-1,6-naphthyridine-3-carboxylate |
CAS: |
52816-67-8 |
Synonyms: |
ethyl 2-methyl-1,6-naphthyridine-3-carboxylate; 2-METHYL-1,6-NAPHTHYRIDINE-3-CARBOXYLIC ETHYL ESTER; 2-METHYL-1,6-NAPHTHYRIDINE-3-CARBOXYLATE, ETHYL ESTER; Peakdale1_000283 |
IUPAC Name: | ethyl 2-methyl-1,6-naphthyridine-3-carboxylate |
Molecular Weight: | 216.24 |
Molecular Formula: | C12H12N2O2 |
Canonical SMILES: | CCOC(=O)C1=C(N=C2C=CN=CC2=C1)C |
InChI: | InChI=1S/C12H12N2O2/c1-3-16-12(15)10-6-9-7-13-5-4-11(9)14-8(10)2/h4-7H,3H2,1-2H3 |
InChI Key: | WQTMJRAYGONFAG-UHFFFAOYSA-N |
Complexity: | 257 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 216.08987763 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 216.08987763 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 52.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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