2-(7-Fluoro-3-indolyl)-2-oxoacetic Acid - CAS 1082892-91-8
Catalog: |
BB002231 |
Product Name: |
2-(7-Fluoro-3-indolyl)-2-oxoacetic Acid |
CAS: |
1082892-91-8 |
Synonyms: |
2-(7-fluoro-1H-indol-3-yl)-2-oxoacetic acid; 2-(7-fluoro-1H-indol-3-yl)-2-oxoacetic acid |
IUPAC Name: | 2-(7-fluoro-1H-indol-3-yl)-2-oxoacetic acid |
Description: | 2-(7-Fluoro-3-indolyl)-2-oxoacetic Acid (CAS# 1082892-91-8 ) is a useful research chemical. |
Molecular Weight: | 207.16 |
Molecular Formula: | C10H6FNO3 |
Canonical SMILES: | C1=CC2=C(C(=C1)F)NC=C2C(=O)C(=O)O |
InChI: | InChI=1S/C10H6FNO3/c11-7-3-1-2-5-6(4-12-8(5)7)9(13)10(14)15/h1-4,12H,(H,14,15) |
InChI Key: | DSBNAVWAMYXVNE-UHFFFAOYSA-N |
LogP: | 1.57430 |
Publication Number | Title | Priority Date |
AU-2009265292-A1 | Calcium ion channel modulators and uses thereof | 20080703 |
CA-2729688-A1 | Calcium ion channel modulators & uses thereof | 20080703 |
EP-2303840-A2 | Calcium ion channel modulators&uses thereof | 20080703 |
JP-2011526618-A | Calcium ion channel modulator and use thereof | 20080703 |
KR-20110046460-A | Calcium ion channel modulators and uses thereof | 20080703 |
Complexity: | 294 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 207.03317122 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 207.03317122 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 70.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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