Ethyl 7-cyclopropyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate - CAS 1245807-84-4
Catalog: |
BB053358 |
Product Name: |
Ethyl 7-cyclopropyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
CAS: |
1245807-84-4 |
Synonyms: |
ethyl7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
IUPAC Name: | ethyl 7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
Molecular Weight: | 232.24 |
Molecular Formula: | C11H12N4O2 |
Canonical SMILES: | CCOC(=O)C1=C(N2C(=NC=N2)N=C1)C3CC3 |
InChI: | InChI=1S/C11H12N4O2/c1-2-17-10(16)8-5-12-11-13-6-14-15(11)9(8)7-3-4-7/h5-7H,2-4H2,1H3 |
InChI Key: | GAQRFWDFNIVRNF-UHFFFAOYSA-N |
Density: | 1.5±0.1 g/cm3 |
Complexity: | 308 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 232.09602564 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 232.09602564 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 69.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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