3-(p-((2-Chloroethyl)(2-fluoroethyl)amino)phenyl)alanine
2-amino-3-[4-[2-chloroethyl(2-fluoroethyl)amino]phenyl]propanoic acid
| Molecular Formula | C13H18ClFN2O2 |
|---|---|
| Molecular Weight | 288.74 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 66.6 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 288.1041 |
| Heavy Atoms | 19 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 1222-64-6 |
|---|---|
| SMILES | C1=CC(=CC=C1CC(C(=O)O)N)N(CCF)CCCl |
| InChIKey | GOVSJKZCEOJJLF-UHFFFAOYSA-N |
📖 Product Overview
3-(p-((2-Chloroethyl)(2-fluoroethyl)amino)phenyl)alanine (CAS: 1222-64-6) is a chemical compound with molecular formula C13H18ClFN2O2 and molecular weight 288.74 g/mol. Its IUPAC systematic name is 2-amino-3-[4-[2-chloroethyl(2-fluoroethyl)amino]phenyl]propanoic acid.
GOVSJKZCEOJJLF-UHFFFAOYSA-N.
SMILES: C1=CC(=CC=C1CC(C(=O)O)N)N(CCF)CCCl.
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