2,4-dimethyl-4H-furo[3,2-b]pyrrole-5-carboxylic acid - CAS 155445-40-2
Catalog: |
BB011118 |
Product Name: |
2,4-dimethyl-4H-furo[3,2-b]pyrrole-5-carboxylic acid |
CAS: |
155445-40-2 |
Synonyms: |
2,4-dimethyl-5-furo[3,2-b]pyrrolecarboxylic acid; 2,4-dimethylfuro[3,2-b]pyrrole-5-carboxylic acid |
IUPAC Name: | 2,4-dimethylfuro[3,2-b]pyrrole-5-carboxylic acid |
Description: | 2,4-dimethyl-4H-furo[3,2-b]pyrrole-5-carboxylic acid (CAS# 155445-40-2) is a useful research chemical. |
Molecular Weight: | 179.175 |
Molecular Formula: | C9H9NO3 |
Canonical SMILES: | CC1=CC2=C(O1)C=C(N2C)C(=O)O |
InChI: | InChI=1S/C9H9NO3/c1-5-3-6-8(13-5)4-7(9(11)12)10(6)2/h3-4H,1-2H3,(H,11,12) |
InChI Key: | FYONTTIMZPLUMM-UHFFFAOYSA-N |
Complexity: | 231 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 179.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 179.058243149 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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