4-ethyl-2-methyl-4H-furo[3,2-b]pyrrole-5-carboxylic acid - CAS 80709-81-5
Catalog: |
BB036542 |
Product Name: |
4-ethyl-2-methyl-4H-furo[3,2-b]pyrrole-5-carboxylic acid |
CAS: |
80709-81-5 |
Synonyms: |
4-ethyl-2-methyl-5-furo[3,2-b]pyrrolecarboxylic acid; 4-ethyl-2-methylfuro[3,2-b]pyrrole-5-carboxylic acid |
IUPAC Name: | 4-ethyl-2-methylfuro[3,2-b]pyrrole-5-carboxylic acid |
Description: | 4-ethyl-2-methyl-4H-furo[3,2-b]pyrrole-5-carboxylic acid (CAS# 80709-81-5) is a useful research chemical. |
Molecular Weight: | 193.202 |
Molecular Formula: | C10H11NO3 |
Canonical SMILES: | CCN1C(=CC2=C1C=C(O2)C)C(=O)O |
InChI: | InChI=1S/C10H11NO3/c1-3-11-7-4-6(2)14-9(7)5-8(11)10(12)13/h4-5H,3H2,1-2H3,(H,12,13) |
InChI Key: | VPPKURVZOYRWIO-UHFFFAOYSA-N |
Complexity: | 244 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.07389321 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.07389321 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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