3-Formylindole-7-carboxylic acid methyl ester - CAS 312973-24-3
Catalog: |
BB043172 |
Product Name: |
3-Formylindole-7-carboxylic acid methyl ester |
CAS: |
312973-24-3 |
Synonyms: |
methyl3-formyl-1H-indole-7-carboxylate; 312973-24-3; 3-FORMYLINDOLE-7-CARBOXYLICACIDMETHYLESTER; methyl3-formylindole-7-carboxylate; 3-Formylindole-7-carboxylicacidmethylester; ZINC00236348 |
IUPAC Name: | methyl 3-formyl-1H-indole-7-carboxylate |
Description: | 3-Formylindole-7-carboxylic acid methyl ester (CAS# 312973-24-3 ) is a useful research chemical. |
Molecular Weight: | 203.19 |
Molecular Formula: | C11H9NO3 |
Canonical SMILES: | COC(=O)C1=CC=CC2=C1NC=C2C=O |
InChI: | InChI=1S/C11H9NO3/c1-15-11(14)9-4-2-3-8-7(6-13)5-12-10(8)9/h2-6,12H,1H3 |
InChI Key: | JVUPHJBFLSMOGY-UHFFFAOYSA-N |
Boiling Point: | 404.4 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.341 g/cm3 |
Complexity: | 267 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.058243149 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 59.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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