
CAS Number79617-97-3
Synonyms(1S,4S)-sertraline*(R)-mandelic acid; (1S-cis)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-naphthalenamine mandelate; (1S,4S)-sertraline (R)-mandelate; (cis-1S)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenamine (R)-mandelate; cis(1S,4S)-N-methyl-4-(3,4-dichlorophenyl)-1,2,3,4-terahydro-1-(2H)-napthalenamine mandelate; (1S-cis)-4-(3,4-dichlorophenol)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenamine mandelate; (1S:4S)-N-Benzoyl-2-oxa-5-azabicyclo<2.2.1>heptan; 5-benzoyl-2-oxa-5-aza-bicyclo[2.2.1]heptane; cis-(1S,4S)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenamine D-(-)-mandelate
Molecular FormulaC17H18N1Cl3
Molecular Weight342.69
Boiling Point416.3ºC at 760 mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 79617-97-3 |
| Catalog No. | 2A-3174873 |
| Chinese Name | cis-(1s,4s)-n-methyl-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-1-naphthalenamine mandelate |
| Synonyms | (1S,4S)-sertraline*(R)-mandelic acid; (1S-cis)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-naphthalenamine mandelate; (1S,4S)-sertraline (R)-mandelate; (cis-1S)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenamine (R)-mandelate; cis(1S,4S)-N-methyl-4-(3,4-dichlorophenyl)-1,2,3,4-terahydro-1-(2H)-napthalenamine mandelate; (1S-cis)-4-(3,4-dichlorophenol)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenamine mandelate; (1S:4S)-N-Benzoyl-2-oxa-5-azabicyclo<2.2.1>heptan; 5-benzoyl-2-oxa-5-aza-bicyclo[2.2.1]heptane; cis-(1S,4S)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenamine D-(-)-mandelate |
| Molecular Formula | C17H18N1Cl3 |
| Molecular Weight | 342.69 |
| Boiling Point | 416.3ºC at 760 mmHg |
| PubChem ID | 15503154 |
| MDL Number | MFCD00895772 |
| SMILES | CNC1CCC(c2ccc(Cl)c(Cl)c2)c2ccccc21.O=C(O)C(O)c1ccccc1 |
| InChI | InChI=1S/C17H17Cl2N.C8H8O3/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11;9-7(8(10)11)6-4-2-1-3-5-6/h2-6,8,10,12,17,20H,7,9H2,1H3;1-5,7,9H,(H,10,11)/t12-,17-;/m0./s1 |
| InChI Key | PKXMFQSWZRRSRR-XHXSRVRCSA-N |
| MSDS | msds/175251_1_79617_97_3.pdf |
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