Kehua AI (Shenzhen) Innovative Drug R&D Co., Ltd.    Healthy Roots Biotechnology (Shenzhen) Co., Limited    Joint Development

1. Primary Information

English name: Cevimeline Hydrochloride Salt
CAS No.: 173553-37-2
Molecular formula: C10H18ClNOS
Molecular weight: 235.77 g/mol
SMILES: CC1OC2(CN3CCC2CC3)CS1.Cl
Structural class:
Other identifiers:

2-methyspiro(1,3-oxathiolane-5,3)quinuclidine

AF 102B

AF 102B, (cis-(+))-isomer

AF 102B, (trans)-isomer

AF-102B

2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 100mg 98% 1600 -20℃ in stock -
Kehua Intelligence 250mg 98% 2640 -20℃ in stock -
Kehua Intelligence 500mg 98% 3600 -20℃ in stock -
Kehua Intelligence 1g 98% 5360 -20℃ in stock -

3. Structures

3.1 2D structure


3.2 3D structure

Coming soon

4. International Nomenclature & Identifiers

4.1 IUPAC Name

2-methylspiro[1,3-oxathiolane-5,3'-1-azabicyclo[2.2.2]octane];hydrochloride


4.2 InChI

InChI=1S/C10H17NOS.ClH/c1-8-12-10(7-13-8)6-11-4-2-9(10)3-5-11;/h8-9H,2-7H2,1H3;1H


4.3 InChIKey

SURWTGAXEIEOGY-UHFFFAOYSA-N


4.4 Canonical SMILES

CC1OC2(CN3CCC2CC3)CS1.Cl


4.5 Isomeric SMILES

-

4.6 SDF file

Coming soon

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

Coming soon

5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

Coming soon
-- No 3D model data available --