| CAS Number | 858186-27-3 |
| Catalog Number | AG01BVQ4 |
| Chemical Name | 4-Aminonaphthalen-1-yl acetate |
| IUPAC Name | (4-aminonaphthalen-1-yl) acetate |
| InChI | InChI=1S/C12H11NO2/c1-8(14)15-12-7-6-11(13)9-4-2-3-5-10(9)12/h2-7H,13H2,1H3 |
| InChI Key | RQKMOUJASOVRPY-UHFFFAOYSA-N |
| MDL Number | MFCD30486598 |
| Molecular Formula | C12H11NO2 |
| Molecular Weight | 201.2212 |
| SMILES | CC(OC1=C2C=CC=CC2=C(N)C=C1)=O |
| Synonyms | 4-aminonaphthalen-1-yl acetate,
858186-27-3,
ZINC96027015,
AKOS033976982,
Z2681543936,
|
| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.225g/mol |
| Monoisotopic Mass | 201.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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