| CAS Number | 1260486-39-2 |
| Catalog Number | AG009J44 |
| Chemical Name | 1-(4-Fluoronaphthalen-1-yl)ethan-1-amine |
| IUPAC Name | 1-(4-fluoronaphthalen-1-yl)ethanamine |
| InChI | InChI=1S/C12H12FN/c1-8(14)9-6-7-12(13)11-5-3-2-4-10(9)11/h2-8H,14H2,1H3 |
| InChI Key | MVNSJXXBMVYRCM-UHFFFAOYSA-N |
| MDL Number | MFCD18706828 |
| Molecular Formula | C12H12FN |
| Molecular Weight | 189.2288 |
| SMILES | CC(C1=C2C(C=CC=C2)=C(F)C=C1)N |
| Synonyms | 1-(4-fluoronaphthalen-1-yl)ethan-1-amine,
1260486-39-2,
SCHEMBL1253164,
AKOS013455359,
1-(4-fluoronaphthalen-1-yl)ethanamine,
(1R)-1-(4-FLUORONAPHTHYL)ETHYLAMINE,
1211568-72-7,
|
| Complexity | 195 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.233g/mol |
| Monoisotopic Mass | 189.095g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
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Certificate of Analysis
Lot Number