| CAS Number | 55432-25-2 |
| Catalog Number | AG00E8IR(AGN-PC-0WQVOK) |
| Chemical Name | N-cyclopentyl-2-nitroaniline |
| IUPAC Name | N-cyclopentyl-2-nitroaniline |
| InChI | InChI=1S/C11H14N2O2/c14-13(15)11-8-4-3-7-10(11)12-9-5-1-2-6-9/h3-4,7-9,12H,1-2,5-6H2 |
| InChI Key | ZQLZSKZOTVXWNW-UHFFFAOYSA-N |
| MDL Number | MFCD11115894 |
| Molecular Formula | C11H14N2O2 |
| Molecular Weight | 206.2411 |
| SMILES | [O-][N+](C1=C(NC2CCCC2)C=CC=C1)=O |
| Synonyms | N-cyclopentyl-2-nitroaniline,
55432-25-2,
cyclopentyl(2-nitrophenyl)amine,
SCHEMBL2930805,
MFCD11115894,
ZINC19998978,
AKOS005208975,
F1911-3514,
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| Complexity | 221 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.245g/mol |
| Monoisotopic Mass | 206.106g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number