C25H25Cl2NO3
458.4 g/mol
APIDanger
(1S-CIS)-4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-N-METHYL-1-NAPHTHALENAMINE 2-HYDROXY-2-PHENYLACETATE
CAS79617-97-3EC420-560-3
Category
API
Compound Class
Amine
Primary Use
Pharmaceutical Raw Material
This compound is a salt form of the active pharmaceutical intermediate used in the manufacturing of sertraline hydrochloride. It consists of a stereochemically defined amine combined with mandelic acid.
pharmaceutical intermediate for sertraline hydrochloride production
Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.
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Related Compounds
StrongSame Parent
Sertraline hydrochloride
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StrongSame Parent
Sertraline
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pharmaceutical raw material
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ReferenceSame Category
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Referencestereoisomer of
4-(3,4-Dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenamine hydrochloride
CAS79617-89-3
pharmaceutical intermediate
Referencesame scaffold
[4-(4-Chloro-phenyl)-1,2,3,4-tetrahydro-naphthalen-1-yl]-methyl-amine
CAS107538-97-6
pharmaceutical intermediate
Safety Reference
Danger
H318Causes serious eye damage
H400Very toxic to aquatic life
H410Very toxic to aquatic life with long lasting effects
H302Harmful if swallowed
H351Suspected of causing cancer
H361Suspected of damaging fertility or the unborn child
Customs Tariff Classification
The international HS code for (1S-CIS)-4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-N-METHYL-1-NAPHTHALENAMINE 2-HYDROXY-2-PHENYLACETATE (CAS 79617-97-3) is 2921.49.
HS code (international, 6-digit)
2921.49
EU CN code (8-digit)
2921 49 00
Classification per the EU customs inventory ECICS (2026-07 snapshot, HS 2022). National tariff lines and product form can affect the final classification.
Identifiers
IUPAC Name
(1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine;2-hydroxy-2-phenylacetic acid
InChIKey
PKXMFQSWZRRSRR-XHXSRVRCSA-N
SMILES
CN[C@H]1CC[C@H](C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl.C1=CC=C(C=C1)C(C(=O)O)O
Synonyms (4)
- sertraline mandelate
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