6,7-Dihydro-5H-pyrrolo[3,4-b]pyridine-2-carboxylic Acid - CAS 1508407-96-2
Catalog: |
BB067444 |
Product Name: |
6,7-Dihydro-5H-pyrrolo[3,4-b]pyridine-2-carboxylic Acid |
CAS: |
1508407-96-2 |
Synonyms: |
5H,6H,7H-pyrrolo[3,4-b]pyridine-2-carboxylic acid; 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-2-carboxylic acid; 5H,6H,7H-pyrrolo[3,4-b]pyridine-2-carboxylicacid |
IUPAC Name: | 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-2-carboxylic acid |
Description: | 6,7-Dihydro-5H-pyrrolo[3,4-b]pyridine-2-carboxylic Acid is a useful synthetic intermediate. |
Molecular Weight: | 164.16 |
Molecular Formula: | C8H8N2O2 |
Canonical SMILES: | C1C2=C(CN1)N=C(C=C2)C(=O)O |
InChI: | InChI=1S/C8H8N2O2/c11-8(12)6-2-1-5-3-9-4-7(5)10-6/h1-2,9H,3-4H2,(H,11,12) |
InChI Key: | CVCOGWQITAHGJL-UHFFFAOYSA-N |
Complexity: | 196 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.058577502 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.058577502 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 62.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -2.6 |
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