Methyl 2-Oxoindoline-4-carboxylate - CAS 90924-46-2
Catalog: |
BB039995 |
Product Name: |
Methyl 2-Oxoindoline-4-carboxylate |
CAS: |
90924-46-2 |
Synonyms: |
2-oxo-1,3-dihydroindole-4-carboxylic acid methyl ester; methyl 2-oxo-1,3-dihydroindole-4-carboxylate |
IUPAC Name: | methyl 2-oxo-1,3-dihydroindole-4-carboxylate |
Description: | Methyl 2-Oxoindoline-4-carboxylate (CAS# 90924-46-2) is a useful research chemical. |
Molecular Weight: | 191.18 |
Molecular Formula: | C10H9NO3 |
Canonical SMILES: | COC(=O)C1=C2CC(=O)NC2=CC=C1 |
InChI: | InChI=1S/C10H9NO3/c1-14-10(13)6-3-2-4-8-7(6)5-9(12)11-8/h2-4H,5H2,1H3,(H,11,12) |
InChI Key: | FBKDEECWCACPLH-UHFFFAOYSA-N |
Boiling Point: | 402 °C at 760 mmHg |
Density: | 1.283 g/cm3 |
LogP: | 1.10580 |
Publication Number | Title | Priority Date |
AU-2017269256-A1 | Aminoacylindazole immunomodulators for treatment of autoimmune diseases | 20160523 |
CA-3025810-A1 | Aminoacylindazole immunomodulators for treatment of autoimmune diseases | 20160523 |
CN-109475530-A | For treating the aminoacyl indazole immunomodulator of autoimmune disease | 20160523 |
EP-3463341-A1 | Aminoacylindazole immunomodulators for treatment of autoimmune diseases | 20160523 |
JP-2019516770-A | Aminoacyl indazole immunomodulators for treating autoimmune diseases | 20160523 |
Complexity: | 264 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.058243149 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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