| CAS Number | 390744-78-2 |
| Catalog Number | AG01DWED(AGN-PC-0RII4D) |
| Chemical Name | (S)-6-Fluoro-2,2-dimethylchroman-4-amine hydrochloride |
| IUPAC Name | (4S)-6-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine;hydrochloride |
| InChI | InChI=1S/C11H14FNO.ClH/c1-11(2)6-9(13)8-5-7(12)3-4-10(8)14-11;/h3-5,9H,6,13H2,1-2H3;1H/t9-;/m0./s1 |
| InChI Key | GHYIDVTWFWGMSW-FVGYRXGTSA-N |
| MDL Number | MFCD24435816 |
| Molecular Formula | C11H15ClFNO |
| Molecular Weight | 231.6943 |
| SMILES | Cl.CC1(OC2=C(C=C(C=C2)F)[C@@H](N)C1)C |
| Synonyms | (S)-6-Fluoro-2,2-dimethylchroman-4-amine hydrochloride,
390744-78-2,
MFCD24435816,
(S)-6-Fluoro-2,2-dimethyl-3,4-dihydro-2H-chromen-4-amine hydrochloride,
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| Complexity | 219 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.083g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.695g/mol |
| Monoisotopic Mass | 231.083g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number