| CAS Number | 1355246-87-5 |
| Catalog Number | AG009X63(AGN-PC-0WAD4W) |
| Chemical Name | Ethyl 4-(2-aminophenyl)benzoate, HCl |
| IUPAC Name | ethyl 4-(2-aminophenyl)benzoate;hydrochloride |
| InChI | InChI=1S/C15H15NO2.ClH/c1-2-18-15(17)12-9-7-11(8-10-12)13-5-3-4-6-14(13)16;/h3-10H,2,16H2,1H3;1H |
| InChI Key | XYRCKRPMVQLITA-UHFFFAOYSA-N |
| MDL Number | MFCD21332985 |
| Molecular Formula | C15H16ClNO2 |
| Molecular Weight | 277.7460 |
| SMILES | CCOC(=O)c1ccc(cc1)c1ccccc1N.Cl |
| Synonyms | 1355246-87-5,
ETHYL 4-(2-AMINOPHENYL)BENZOATE, HCL,
Ethyl 4-(2-aminophenyl)benzoate hydrochloride,
Ethyl 4-(2-aminophenyl)benzoate HCl,
MFCD21332985,
Z9939,
C15H15NO2.HCl,
B-8720,
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| Complexity | 272 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 277.087g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 277.748g/mol |
| Monoisotopic Mass | 277.087g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number