| CAS Number | 2825-64-1 |
| Catalog Number | AG00BETZ(AGN-PC-0WB43S) |
| Chemical Name | N,2-diphenylalanine |
| IUPAC Name | 2-anilino-2-phenylpropanoic acid |
| InChI | InChI=1S/C15H15NO2/c1-15(14(17)18,12-8-4-2-5-9-12)16-13-10-6-3-7-11-13/h2-11,16H,1H3,(H,17,18) |
| InChI Key | AAEHCOPCHOUPLL-UHFFFAOYSA-N |
| MDL Number | MFCD05228551 |
| Molecular Formula | C15H15NO2 |
| Molecular Weight | 241.2851 |
| SMILES | C(C)(C1=CC=CC=C1)(NC1C=CC=CC=1)C(O)=O |
| Synonyms | N,2-DIPHENYLALANINE,
2825-64-1,
CHEMBRDG-BB 4140262,
SCHEMBL363022,
N,2-Diphenylalanine, AldrichCPR,
ZX-CM014657,
MFCD05228551,
AKOS010219385,
ACM2825641,
2-Phenyl-2-(phenylamino)propionic acid,
BB0265988,
Y-1682,
4140262-25G,
4140262-50G,
4140262-100G,
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| Complexity | 280 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.29g/mol |
| Monoisotopic Mass | 241.11g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number