AC1NE0XN
2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]propanoic acid
Also Known As: Oprea1_010145|(2S)-2-[2-({4-Oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl}oxy)acetamido]propanoic acid|2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]propanoic acid
CAS: 956236-91-2
| Molecular Formula | C17H17NO6 |
|---|---|
| Molecular Weight | 331.1056 g/mol |
| LogP | 1.2498 |
| Topological Polar Surface Area | 105.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.1056 |
| Monoisotopic Mass | 331.1056 |
| Heavy Atoms | 24 |
| Complexity | 869.2452 |
Chemical Identifiers
| CAS Number | 956236-91-2 |
|---|---|
| SMILES | CC(C(=O)O)NC(=O)COC1=CC2=C(C=C1)C3=C(CCC3)C(=O)O2 |
Product Overview
AC1NE0XN (CAS 956236-91-2), with molecular formula C17H17NO6 and molecular weight 331.1056 g/mol. IUPAC: 2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]propanoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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