| CAS Number | 1807890-95-4 |
| Catalog Number | AG01BCXW(AGN-PC-0WORC2) |
| Chemical Name | (4S)-8-methyl-3,4-dihydro-2H-1-benzopyran-4-amine hydrochloride |
| IUPAC Name | (4S)-8-methyl-3,4-dihydro-2H-chromen-4-amine;hydrochloride |
| InChI | InChI=1S/C10H13NO.ClH/c1-7-3-2-4-8-9(11)5-6-12-10(7)8;/h2-4,9H,5-6,11H2,1H3;1H/t9-;/m0./s1 |
| InChI Key | UOOASZNLOHDNQY-FVGYRXGTSA-N |
| MDL Number | MFCD24435617 |
| Molecular Formula | C10H14ClNO |
| Molecular Weight | 199.6773 |
| SMILES | N[C@H]1CCOc2c1cccc2C.Cl |
| Synonyms | (4S)-8-methyl-3,4-dihydro-2H-1-benzopyran-4-amine hydrochloride,
1807890-95-4,
AKOS026741650,
NE34847,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.678g/mol |
| Monoisotopic Mass | 199.076g/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
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