| CAS Number | 5883-84-1 |
| Catalog Number | AG00IAGI(AGN-PC-0LW1VI) |
| Chemical Name | 2-(4-ethoxyphenyl)-1H-indole |
| IUPAC Name | 2-(4-ethoxyphenyl)-1H-indole |
| InChI | InChI=1S/C16H15NO/c1-2-18-14-9-7-12(8-10-14)16-11-13-5-3-4-6-15(13)17-16/h3-11,17H,2H2,1H3 |
| InChI Key | MKEFYFHAXIUFLA-UHFFFAOYSA-N |
| MDL Number | MFCD05224899 |
| Molecular Formula | C16H15NO |
| Molecular Weight | 237.2964 |
| SMILES | CCOc1ccc(cc1)c1cc2c([nH]1)cccc2 |
| Synonyms | 2-(4-ethoxyphenyl)-1H-indole,
5883-84-1,
1H-Indole, 2-(4-ethoxyphenyl)-,
AIN-1726,
ZINC1519027,
ZX-BK001794,
BBL021276,
KM4803,
MFCD05224899,
STK893982,
AKOS005143694,
MCULE-2775680539,
NCGC00320380-01,
2-(4-Ethoxyphenyl)-1H-indole, AldrichCPR,
AB01315499-02,
ZINC01519027,
CID6991892,
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| Complexity | 260 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.302g/mol |
| Monoisotopic Mass | 237.115g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 25A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number