| CAS Number | 88514-36-7 |
| Catalog Number | AG0048JZ(AGN-PC-01GB46) |
| Chemical Name | 2-(4-Ethylphenyl)-1H-indole |
| IUPAC Name | 2-(4-ethylphenyl)-1H-indole |
| InChI | InChI=1S/C16H15N/c1-2-12-7-9-13(10-8-12)16-11-14-5-3-4-6-15(14)17-16/h3-11,17H,2H2,1H3 |
| InChI Key | LCPDSVIPOHXQCP-UHFFFAOYSA-N |
| MDL Number | MFCD05224920 |
| Molecular Formula | C16H15N |
| Molecular Weight | 221.2970 |
| SMILES | CCc1ccc(cc1)c1cc2c([nH]1)cccc2 |
| Synonyms | 2-(4-ethylphenyl)-1H-indole,
88514-36-7,
1H-Indole, 2-(4-ethylphenyl)-,
ACMC-20laq0,
SCHEMBL8025177,
CTK3B0438,
DTXSID20589584,
AIN-1758,
ZINC1519052,
ZX-BK001749,
BBL021242,
KM4270,
MFCD05224920,
STK893948,
AKOS005143692,
MCULE-6682531736,
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| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.303g/mol |
| Monoisotopic Mass | 221.12g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 15.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number