| CAS Number | 243467-60-9 |
| Catalog Number | AG019ESE(AGN-PC-03R3VJ) |
| Chemical Name | 1-(4-FLUOROPHENYL)-1H-INDOLE-5-CARBOXYLICACID |
| IUPAC Name | 1-(4-fluorophenyl)indole-5-carboxylic acid |
| InChI | InChI=1S/C15H10FNO2/c16-12-2-4-13(5-3-12)17-8-7-10-9-11(15(18)19)1-6-14(10)17/h1-9H,(H,18,19) |
| InChI Key | OHQPVSORYCUZRN-UHFFFAOYSA-N |
| MDL Number | MFCD26386298 |
| Molecular Formula | C15H10FNO2 |
| Molecular Weight | 255.2438 |
| SMILES | N1(C=CC=2C=C(C=CC12)C(=O)O)C=3C=CC(=CC3)F |
| Synonyms | 1-(4-fluorophenyl)-1h-indole-5-carboxylic acid,
243467-60-9,
1-(4-FLUOROPHENYL)-1H-INDOLE-5-CARBOXYLICACID,
SCHEMBL121755,
OHQPVSORYCUZRN-UHFFFAOYSA-N,
MFCD26386298,
CS-0062097,
1-(4-fluorophenyl)-indole-5-carboxylic acid,
1-(4-fluoro-phenyl)-1H-indole-5-carboxylic acid,
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| Complexity | 341 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 255.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 255.248g/mol |
| Monoisotopic Mass | 255.07g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
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Certificate of Analysis
Lot Number