2-{4-oxo-4H,5H-furo[3,2-c]pyridin-5-yl}acetic acid - CAS 1936329-25-7
Catalog: |
BB015000 |
Product Name: |
2-{4-oxo-4H,5H-furo[3,2-c]pyridin-5-yl}acetic acid |
CAS: |
1936329-25-7 |
Synonyms: |
2-(4-oxo-5-furo[3,2-c]pyridinyl)acetic acid; 2-(4-oxofuro[3,2-c]pyridin-5-yl)acetic acid |
IUPAC Name: | 2-(4-oxofuro[3,2-c]pyridin-5-yl)acetic acid |
Description: | 2-{4-oxo-4H,5H-furo[3,2-c]pyridin-5-yl}acetic acid (CAS# 1936329-25-7) is a useful research chemical. |
Molecular Weight: | 193.158 |
Molecular Formula: | C9H7NO4 |
Canonical SMILES: | C1=CN(C(=O)C2=C1OC=C2)CC(=O)O |
InChI: | InChI=1S/C9H7NO4/c11-8(12)5-10-3-1-7-6(9(10)13)2-4-14-7/h1-4H,5H2,(H,11,12) |
InChI Key: | IFIKZIZGJSCVHS-UHFFFAOYSA-N |
Complexity: | 299 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.0375077 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.0375077 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 70.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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