| CAS Number | 1246094-87-0 |
| Catalog Number | AG00A1F7 |
| Chemical Name | 6-Chloro-DPAT Hydrochloride |
| IUPAC Name | 6-chloro-N,N-dipropyl-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride |
| InChI | InChI=1S/C16H24ClN.ClH/c1-3-9-18(10-4-2)16-8-6-13-11-15(17)7-5-14(13)12-16;/h5,7,11,16H,3-4,6,8-10,12H2,1-2H3;1H |
| InChI Key | RUPKPEDJJAADJK-UHFFFAOYSA-N |
| MDL Number | MFCD10565900 |
| Molecular Formula | C16H25Cl2N |
| Molecular Weight | 302.2824 |
| SMILES | CCCN(CCC)C1CCC2=C(C1)C=CC(=C2)Cl.Cl |
| Synonyms | 6-Chloro-DPAT hydrochloride,
1246094-87-0,
(6-Chloro-1,2,3,4-tetrahydro-naphthalen-2-yl)-dipropyl-amine hydrochloride,
1246242-29-4,
6-chloro-N,N-dipropyl-tetralin-2-amine hydrochloride,
|
| Complexity | 237 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 301.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 302.283g/mol |
| Monoisotopic Mass | 301.136g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 3.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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