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Home > Products > Specialty & Industrial Chemicals > Specialty Chemicals > [2R-(2a,3b,11bb)]-1,3,4,6,7,11b-Hexahydro-9,10-dimethoxy-3-(2-methylpropyl)-2H-benzo[a]quinolizin-2-ol
[2R-(2a,3b,11bb)]-1,3,4,6,7,11b-Hexahydro-9,10-dimethoxy-3-(2-methylpropyl)-2H-benzo[a]quinolizin-2-ol structure, CAS 85081-18-1

[2R-(2a,3b,11bb)]-1,3,4,6,7,11b-Hexahydro-9,10-dimethoxy-3-(2-methylpropyl)-2H-benzo[a]quinolizin-2-ol

CAS Number85081-18-1

Synonyms(+)-dihydrotetrabenzaine; trans-2 hydroxy-3 isobutyl-9,10 dimethoxy-1,2,3,4,6,7 hexahydro-11bH-benzo(a)quinolizine; 2H-Benzo[a]quinolizin-2-ol,1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-3-(2-methylpropyl)-,(2R,3R,11bR); (Â-)-dihydrotetrabenazine; (2S,3S,11bS)-3-Isobutyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-ol; WEQLWGNDNRARGE-DJIMGWMZSA; NBI-98782

Molecular FormulaC19H29NO3

Molecular Weight319.44

Purity98.00%

Density1.1±0.1 g/cm3

Boiling Point457.8±45.0 °C at 760 mmHg

Melting Point

Flash Point

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Cat. No.: 2A-9049175 Purity: 98.00%
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Quality Control of [ 85081-18-1 ] Purity: 98.00% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number85081-18-1
Catalog No.2A-9049175
Chinese NameNBI-98782
Synonyms(+)-dihydrotetrabenzaine; trans-2 hydroxy-3 isobutyl-9,10 dimethoxy-1,2,3,4,6,7 hexahydro-11bH-benzo(a)quinolizine; 2H-Benzo[a]quinolizin-2-ol,1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-3-(2-methylpropyl)-,(2R,3R,11bR); (Â-)-dihydrotetrabenazine; (2S,3S,11bS)-3-Isobutyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-ol; WEQLWGNDNRARGE-DJIMGWMZSA; NBI-98782
Molecular FormulaC19H29NO3
Molecular Weight319.44
Purity98.00
Density1.1±0.1 g/cm3
Boiling Point457.8±45.0 °C at 760 mmHg
Storage Condition2-8℃
ApplicationNBI-98782 (alpha-dihydrotetrabenazine) is a vesicular monoamine transporter (VMAT2) inhibitor with a Ki of 0.97nM.
PubChem ID42617958
MDL NumberC19H29NO3
SMILESCOc1cc2c(cc1OC)C1CC(O)C(CC(C)C)CN1CC2
InChIInChI=1S/C19H29NO3/c1-12(2)7-14-11-20-6-5-13-8-18(22-3)19(23-4)9-15(13)16(20)10-17(14)21/h8-9,12,14,16-17,21H,5-7,10-11H2,1-4H3/t14-,16-,17-/m1/s1
InChI KeyWEQLWGNDNRARGE-DJIMGWMZSA-N
MSDSmsds/49175_1_85081_18_1.pdf
Transport InfoProduct name: NBI-98782
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