| CAS Number | 1250834-99-1 |
| Catalog Number | AG000N3H(AGN-PC-0EKALH) |
| Chemical Name | N-Cyclopentyl-5-fluoro-2-nitroaniline |
| IUPAC Name | N-cyclopentyl-5-fluoro-2-nitroaniline |
| InChI | InChI=1S/C11H13FN2O2/c12-8-5-6-11(14(15)16)10(7-8)13-9-3-1-2-4-9/h5-7,9,13H,1-4H2 |
| InChI Key | UIVSDNDIJOYWAU-UHFFFAOYSA-N |
| MDL Number | MFCD16754137 |
| Molecular Formula | C11H13FN2O2 |
| Molecular Weight | 224.2315 |
| SMILES | Fc1ccc(c(c1)NC1CCCC1)[N+](=O)[O-] |
| Synonyms | N-Cyclopentyl-5-fluoro-2-nitroaniline,
1250834-99-1,
ACMC-209atk,
CTK8A9583,
DTXSID10734384,
ANW-18294,
MFCD16754137,
ZINC52119065,
AKOS011663098,
TC-107039,
Z8849,
Benzenamine, N-cyclopentyl-5-fluoro-2-nitro-,
B-8786,
C11H13FN2O2,
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| Complexity | 251 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.096g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.235g/mol |
| Monoisotopic Mass | 224.096g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number