3-Formyl-7-indazole carboxylic Acid methyl ester - CAS 898747-28-9
Catalog: |
BB064601 |
Product Name: |
3-Formyl-7-indazole carboxylic Acid methyl ester |
CAS: |
898747-28-9 |
Synonyms: |
Methyl 3-formyl-1H-indazole-7-carboxylate; 3-Formyl-7-indazole carboxylic acid methyl ester; methyl 3-formyl-2H-indazole-7-carboxylate; 1h-indazole-7-carboxylic acid,3-formyl-,methyl ester |
IUPAC Name: | methyl 3-formyl-2H-indazole-7-carboxylate |
Description: | 3-Formyl-7-indazole carboxylic acid methyl ester (cas# 898747-28-9) is a useful research chemical. |
Molecular Weight: | 204.18 |
Molecular Formula: | C10H8N2O3 |
Canonical SMILES: | COC(=O)C1=CC=CC2=C(NN=C21)C=O |
InChI: | InChI=1S/C10H8N2O3/c1-15-10(14)7-4-2-3-6-8(5-13)11-12-9(6)7/h2-5H,1H3,(H,11,12) |
InChI Key: | HVPVQYHYAQLCDZ-UHFFFAOYSA-N |
Complexity: | 269 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 204.05349212 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 204.05349212 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 72Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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