| CAS Number | 259860-04-3 |
| Catalog Number | AG00CGXS(AGN-PC-0WOFUE) |
| Chemical Name | 1H-Indole, 6-chloro-7-fluoro- |
| IUPAC Name | 6-chloro-7-fluoro-1H-indole |
| InChI | InChI=1S/C8H5ClFN/c9-6-2-1-5-3-4-11-8(5)7(6)10/h1-4,11H |
| InChI Key | OPEAQMMQYFSXKX-UHFFFAOYSA-N |
| MDL Number | MFCD12924614 |
| Molecular Formula | C8H5ClFN |
| Molecular Weight | 169.5834 |
| SMILES | Clc1ccc2c(c1F)[nH]cc2 |
| Synonyms | 6-chloro-7-fluoro-1H-indole,
259860-04-3,
1H-Indole, 6-chloro-7-fluoro-,
6-Chloro-7-fluoroindole,
6-chloro-7-fluoro indole,
SCHEMBL2535332,
OPEAQMMQYFSXKX-UHFFFAOYSA-N,
ZINC89209134,
AKOS027460353,
NE61748,
Z2469680368,
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| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.583g/mol |
| Monoisotopic Mass | 169.009g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 15.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number