Methyl 6-Fluoroindole-3-acetate - CAS 5159-07-9
Catalog: |
BB027507 |
Product Name: |
Methyl 6-Fluoroindole-3-acetate |
CAS: |
5159-07-9 |
Synonyms: |
2-(6-fluoro-1H-indol-3-yl)acetic acid methyl ester; methyl 2-(6-fluoro-1H-indol-3-yl)acetate |
IUPAC Name: | methyl 2-(6-fluoro-1H-indol-3-yl)acetate |
Description: | Methyl 6-Fluoroindole-3-acetate (CAS# 5159-07-9 ) is a useful research chemical. |
Molecular Weight: | 207.20 |
Molecular Formula: | C11H10FNO2 |
Canonical SMILES: | COC(=O)CC1=CNC2=C1C=CC(=C2)F |
InChI: | InChI=1S/C11H10FNO2/c1-15-11(14)4-7-6-13-10-5-8(12)2-3-9(7)10/h2-3,5-6,13H,4H2,1H3 |
InChI Key: | AVSUEWDZNVTLFF-UHFFFAOYSA-N |
LogP: | 2.02250 |
Publication Number | Title | Priority Date |
CN-113292557-A | Pyridopyrimidinone mesoion derivative containing indole unit and preparation method and application thereof | 20210531 |
Complexity: | 247 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 207.06955672 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 207.06955672 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 42.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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