| CAS Number | 1427366-48-0 |
| Catalog Number | AG00IL9X(AGN-PC-0WRAJ5) |
| Chemical Name | 7-fluoro-4-methoxy-2-methyl-1H-indole |
| IUPAC Name | 7-fluoro-4-methoxy-2-methyl-1H-indole |
| InChI | InChI=1S/C10H10FNO/c1-6-5-7-9(13-2)4-3-8(11)10(7)12-6/h3-5,12H,1-2H3 |
| InChI Key | IFEFOSKSUIPVLH-UHFFFAOYSA-N |
| MDL Number | MFCD23706386 |
| Molecular Formula | C10H10FNO |
| Molecular Weight | 179.1909 |
| SMILES | FC=1C=CC(=C2C=C(NC12)C)OC |
| Synonyms | 7-Fluoro-4-methoxy-2-methyl-1H-indole,
1427366-48-0,
CS-0050025,
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| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.194g/mol |
| Monoisotopic Mass | 179.075g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 25A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number