Ethyl 7-methyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate - CAS 90558-96-6
Catalog: |
BB053117 |
Product Name: |
Ethyl 7-methyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
CAS: |
90558-96-6 |
Synonyms: |
ethyl 7-methyl-8-hydro-1,2,4-triazolo[1,5-a]pyrimidine-6-carboxylate |
IUPAC Name: | ethyl 7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
Molecular Weight: | 206.2 |
Molecular Formula: | C9H10N4O2 |
Canonical SMILES: | CCOC(=O)C1=C(N2C(=NC=N2)N=C1)C |
InChI: | InChI=1S/C9H10N4O2/c1-3-15-8(14)7-4-10-9-11-5-12-13(9)6(7)2/h4-5H,3H2,1-2H3 |
InChI Key: | CFWWNMHTTMZNJQ-UHFFFAOYSA-N |
Density: | 1.4±0.1 g/cm3 |
Complexity: | 248 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.08037557 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.08037557 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 69.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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