| CAS Number | 57638-63-8 |
| Catalog Number | AG00IA9J(AGN-PC-009AQ3) |
| Chemical Name | 1H-Indole, 2-(3-methoxyphenyl)- |
| IUPAC Name | 2-(3-methoxyphenyl)-1H-indole |
| InChI | InChI=1S/C15H13NO/c1-17-13-7-4-6-11(9-13)15-10-12-5-2-3-8-14(12)16-15/h2-10,16H,1H3 |
| InChI Key | BROVFBHLXAOTKQ-UHFFFAOYSA-N |
| MDL Number | MFCD05224896 |
| Molecular Formula | C15H13NO |
| Molecular Weight | 223.2698 |
| SMILES | COc1cccc(c1)c1cc2c([nH]1)cccc2 |
| Synonyms | 2-(3-methoxyphenyl)-1H-indole,
57638-63-8,
1h-indole,2-(3-methoxyphenyl)-,
AIN-1722,
ZINC1519024,
ZX-BK002864,
1H-Indole, 2-(3-methoxyphenyl)-,
BBL022374,
KM0130,
MFCD05224896,
STK895555,
AKOS005143693,
MCULE-3189529642,
3-(1H-indol-2-yl)phenyl methyl ether,
SC-60572,
AS-662/43412997,
CID11447413,
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| Complexity | 255 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.275g/mol |
| Monoisotopic Mass | 223.1g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 25A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number