BRN 1089200
2-[2-(4-nitrophenyl)-1,3-benzoxazol-5-yl]propanoic acid
| Molecular Formula | C16H12N2O5 |
|---|---|
| Molecular Weight | 312.28 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 109.0 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.07462 |
| Heavy Atoms | 23 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 51234-92-5 |
|---|---|
| SMILES | CC(C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)O |
| InChIKey | YLUWIWDPTZHXQS-UHFFFAOYSA-N |
📖 Product Overview
BRN 1089200 (CAS: 51234-92-5) is a chemical compound with molecular formula C16H12N2O5 and molecular weight 312.28 g/mol. Its IUPAC systematic name is 2-[2-(4-nitrophenyl)-1,3-benzoxazol-5-yl]propanoic acid.
YLUWIWDPTZHXQS-UHFFFAOYSA-N.
SMILES: CC(C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)O.
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