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Tianeptine

IUPAC: 7-[(3-chloro-6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepin-11-yl)amino]heptanoic acid
Salt: Sulfate
CAS: 1224690-84-9

Batch Date: November 2022
Minimum Quantity: 0.5g 


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Molecular Formula: C21H24ClN2NaO4S

Formula Weight: 458.934029

Composition: C(54.96%) H(5.27%) Cl(7.73%) N(6.10%) Na(5.01%) O(13.94%) S(6.99%)

Molar Refractivity: Not available

Molar Volume: Not available

Parachor: Not available

Index of Refraction: Not available

Surface Tension: Not available

Density: Not available

Dielectric Constant: Not available

Polarizability: Not available

RDBE: 11

Monoisotopic Mass: 458.1043 Da

Nominal Mass: 458 Da

Average Mass: 458.934 Da

M+: 458.103751 Da

M-: 458.104849 Da

[M+H]+: 459.111576 Da

[M+H]-: 459.112674 Da

[M-H]+: 457.095926 Da

[M-H]-: 457.097024 Da
Data predicted using ACDLabs Software