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Reference substance information

IUPAC name:
(6S)-6-{propyl[2-(2-thienyl)ethyl]amino}-5,6,7,8-tetrahydronaphthalen-1-ol hydrochloride (1:1)
Synonyms
Names:
(S)-(-)-5,6,7,8-Tetrahydro-6-6[propyl[2-(2-thienyl)ethyl]amino]-1-naphthalenol
Identifier:
CAS number
125572-93-2
Identifier:
IUPAC name
(6S)-6-(propyl-(2-thiophen-2-ylethyl)amino)tetralin-1-ol hydrochloride
Identifier:
other: InChl
1S/C19H25NOS.ClH/c1-2-11-20(12-10-17-6-4-13-22-17)16-8-9-18-15(14-16)5-3-7-19(18)21;/h3-7,13,16,21H,2,8-12,14H2,1H3;1H/t16-;/m0./s1
Identifier:
other: Molecular formula
C19H25NOS*HCl
Identifier:
other: SMILES notation
OC1=C2C(C[C@@H](N(CCC3=CC=CS3)CCC)CC2)=CC=C1.Cl
(6S)-6-{propyl[2-(2-thienyl)ethyl]amino}-5,6,7,8-tetrahydronaphthalen-1-ol hydrochloride (1:1)

CAS information

CAS number:
125572-93-2

Molecular and structural information

Molecular formula:
C19H26NOSCl
Molecular weight:
351.9
SMILES notation:
Cl[H].CCCN(CCC1=CC=CS1)[C@H]1CCC2=C(C1)C=CC=C2O
InChl:
InChI=1S/C19H25NOS.ClH/c1-2-11-20(12-10-17-6-4-13-22-17)16-8-9-18-15(14-16)5-3-7-19(18)21;/h3-7,13,16,21H,2,8-12,14H2,1H3;1H/t16-;/m0./s1
Structural formula:
Chemical structure