7-Chloro-4-methoxyisatin - CAS 15345-55-8
Catalog: |
BB010903 |
Product Name: |
7-Chloro-4-methoxyisatin |
CAS: |
15345-55-8 |
Synonyms: |
7-chloro-4-methoxy-1H-indole-2,3-dione; 7-chloro-4-methoxy-1H-indole-2,3-dione |
IUPAC Name: | 7-chloro-4-methoxy-1H-indole-2,3-dione |
Description: | 7-Chloro-4-methoxyisatin (CAS# 15345-55-8 ) is a useful research chemical. |
Molecular Weight: | 211.60 |
Molecular Formula: | C9H6ClNO3 |
Canonical SMILES: | COC1=C2C(=C(C=C1)Cl)NC(=O)C2=O |
InChI: | InChI=1S/C9H6ClNO3/c1-14-5-3-2-4(10)7-6(5)8(12)9(13)11-7/h2-3H,1H3,(H,11,12,13) |
InChI Key: | DVVWQQZWRTXTMK-UHFFFAOYSA-N |
Density: | 1.474 g/cm3 |
LogP: | 1.62140 |
Publication Number | Title | Priority Date |
CN-111574426-A | Diamine monomer containing isoindigo structure and black polyimide synthesized from diamine monomer | 20200527 |
AU-2016358242-A1 | N-substituted indole derivatives as PGE2 receptor modulators | 20151120 |
CA-3002610-A1 | N-substituted indole derivatives as pge2 receptor modulators | 20151120 |
EP-3377483-A1 | N-substituted indole derivatives as pge2 receptor modulators | 20151120 |
JP-2018534328-A | N-substituted indole derivatives as PGE2 receptor modulators | 20151120 |
Complexity: | 281 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.0036207 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.0036207 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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