6-(2-Hydroxyethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid - CAS 1018125-47-7
Catalog: |
BB048217 |
Product Name: |
6-(2-Hydroxyethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid |
CAS: |
1018125-47-7 |
Synonyms: |
6-(2-hydroxyethyl)-8-hydro-1,2,4-triazolo[1,5-a]pyrimidine-2-carboxylic acid |
IUPAC Name: | 6-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid |
Description: | 6-(2-Hydroxyethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid (CAS# 1018125-47-7 ) is a useful research chemical. |
Molecular Weight: | 208.17 |
Molecular Formula: | C8H8N4O3 |
Canonical SMILES: | C1=C(C=NC2=NC(=NN21)C(=O)O)CCO |
InChI: | InChI=1S/C8H8N4O3/c13-2-1-5-3-9-8-10-6(7(14)15)11-12(8)4-5/h3-4,13H,1-2H2,(H,14,15) |
InChI Key: | JRYQBTYZPJNHKZ-UHFFFAOYSA-N |
Density: | 1.71±0.1 g/cm3 |
Complexity: | 250 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.05964013 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.05964013 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 101 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.5 |
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