| CAS Number | 2061996-42-5 |
| Catalog Number | AG01DU55 |
| Chemical Name | (S)-8-Chlorochroman-4-Amine Hydrochloride |
| IUPAC Name | (4S)-8-chloro-3,4-dihydro-2H-chromen-4-amine;hydrochloride |
| InChI | InChI=1S/C9H10ClNO.ClH/c10-7-3-1-2-6-8(11)4-5-12-9(6)7;/h1-3,8H,4-5,11H2;1H/t8-;/m0./s1 |
| InChI Key | BXLLHMUHNIPMNB-QRPNPIFTSA-N |
| MDL Number | MFCD24435623 |
| Molecular Formula | C9H11Cl2NO |
| Molecular Weight | 220.0957 |
| SMILES | N[C@H]1CCOC2=C1C=CC=C2Cl.[H]Cl |
| Synonyms | (S)-8-Chlorochroman-4-amine hydrochloride,
2061996-42-5,
(4S)-8-chloro-3,4-dihydro-2h-1-benzopyran-4-amine hydrochloride,
KS-00000U2L,
GS-7328,
1228542-35-5,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.021769g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.09g/mol |
| Monoisotopic Mass | 219.021769g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 35.2Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number