TL;DR: [(3-Nitrophenyl)methylideneamino] cyclopropanecarboxylate (CAS 1359730-93-0) is a chemical compound with molecular formula C11H10N2O4 and molecular weight 234.06406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(3-nitrophenyl)methylideneamino] cyclopropanecarboxylate
Also Known As: 1-({[(cyclopropylcarbonyl)oxy]imino}methyl)-3-nitrobenzene, [(3-nitrophenyl)methylideneamino] cyclopropanecarboxylate
| Molecular Formula | C11H10N2O4 |
| Molecular Weight | 234.06406 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 84.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.06406 Da |
| Heavy Atoms | 17 |
| Complexity | 333.0 |
| SMILES | C1CC1C(=O)ON=CC2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | IPKWZAYYRGUZMQ-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(3-Nitrophenyl)methylideneamino] cyclopropanecarboxylate. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [(3-Nitrophenyl)methylideneamino] cyclopropanecarboxylate. Following Lipinski's Rule of Five, [(3-Nitrophenyl)methylideneamino] cyclopropanecarboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [(3-Nitrophenyl)methylideneamino] cyclopropanecarboxylate is 1359730-93-0.
The molecular formula of [(3-Nitrophenyl)methylideneamino] cyclopropanecarboxylate is C11H10N2O4.
The molecular weight of [(3-Nitrophenyl)methylideneamino] cyclopropanecarboxylate is 234.06406 g/mol.
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