1H-Pyrazolo[3,4-b]pyrazine-3-carboxylic Acid - CAS 1286754-47-9
Catalog: |
BB057971 |
Product Name: |
1H-Pyrazolo[3,4-b]pyrazine-3-carboxylic Acid |
CAS: |
1286754-47-9 |
Synonyms: |
1H-Pyrazolo[3,4-b]pyrazine-3-carboxylic acid; 2H-pyrazolo[3,4-b]pyrazine-3-carboxylic acid; 1H-pyrazolo[3,4-b]pyrazine-3-carboxylicacid |
IUPAC Name: | 2H-pyrazolo[3,4-b]pyrazine-3-carboxylic acid |
Description: | 1H-Pyrazolo[3,4-b]pyrazine-3-carboxylic acid (cas# 1286754-47-9) is a useful research chemical. |
Molecular Weight: | 164.12 |
Molecular Formula: | C6H4N4O2 |
Canonical SMILES: | C1=NC2=C(NN=C2N=C1)C(=O)O |
InChI: | InChI=1S/C6H4N4O2/c11-6(12)4-3-5(10-9-4)8-2-1-7-3/h1-2H,(H,11,12)(H,8,9,10) |
InChI Key: | MWPWLVCWUBHDTP-UHFFFAOYSA-N |
Complexity: | 198 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.03342538 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.03342538 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 91.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.3 |
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