Methyl 7-Hydroxy-2,3-dimethyl-1H-indole-5-carboxylate
Catalog: |
BB060418 |
Product Name: |
Methyl 7-Hydroxy-2,3-dimethyl-1H-indole-5-carboxylate |
Synonyms: |
Methyl 7-Hydroxy-2,3-dimethylindole-5-carboxylate; SY286839; Methyl 7-hydroxy-2,3-dimethyl-1H-indole-5-carboxylate |
IUPAC Name: | methyl 7-hydroxy-2,3-dimethyl-1H-indole-5-carboxylate |
Description: | Methyl 7-Hydroxy-2,3-dimethyl-1H-indole-5-carboxylate is a reagent used in organic synthesis. |
Molecular Weight: | 219.29 |
Molecular Formula: | C12H13NO3 |
Canonical SMILES: | CC1=C(NC2=C1C=C(C=C2O)C(=O)OC)C |
InChI: | InChI=1S/C12H13NO3/c1-6-7(2)13-11-9(6)4-8(5-10(11)14)12(15)16-3/h4-5,13-14H,1-3H3 |
InChI Key: | ZXOVEOQAPFXEMM-UHFFFAOYSA-N |
Complexity: | 281 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.08954328 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.08954328 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 62.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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