| CAS Number | 881040-80-8 |
| Catalog Number | AG00IEWV(AGN-PC-0WP1M6) |
| Chemical Name | 2-([1,1'-Biphenyl]-2-carbonyl)-5-aminopentanoic acid |
| IUPAC Name | 5-amino-2-(2-phenylbenzoyl)pentanoic acid |
| InChI | InChI=1S/C18H19NO3/c19-12-6-11-16(18(21)22)17(20)15-10-5-4-9-14(15)13-7-2-1-3-8-13/h1-5,7-10,16H,6,11-12,19H2,(H,21,22) |
| InChI Key | PWXAZRIILJDHMT-UHFFFAOYSA-N |
| MDL Number | MFCD04966988 |
| Molecular Formula | C18H19NO3 |
| Molecular Weight | 297.3484 |
| SMILES | NCCCC(C(=O)c1ccccc1c1ccccc1)C(=O)O |
| Synonyms | 881040-80-8,
5-amino-2-(biphenyl-2-ylcarbonyl)pentanoic acid,
5-amino-2-([1,1'-biphenyl]-2-ylcarbonyl)pentanoic acid,
2-([1,1'-Biphenyl]-2-carbonyl)-5-aminopentanoic acid,
5-amino-2-(2-phenylbenzoyl)pentanoic Acid,
AC1NFWKR,
MIX-0092,
ZX-BK000721,
BBL020736,
MFCD04966988,
STK893426,
AKOS001476332,
MCULE-9130989240,
H8775,
CID4715053,
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| Complexity | 377 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 297.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 297.354g/mol |
| Monoisotopic Mass | 297.136g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 80.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number