CAS 6533-68-2

Benzeneacetic acid, α-(hydroxymethyl)-, (1α,2β,4β,5α,7β)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester, hydrobromide, hydrate (1:1:3), (αS)-

Description:

Benzeneacetic acid, α-(hydroxymethyl)-, (1α,2β,4β,5α,7β)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester, hydrobromide, hydrate (1:1:3), (αS)-, with CAS number 6533-68-2, is a complex organic compound characterized by its unique tricyclic structure and the presence of both hydroxymethyl and ester functional groups. This compound exhibits properties typical of both aromatic and aliphatic compounds, contributing to its potential reactivity and solubility characteristics. The hydrobromide form indicates that it is a salt, which may enhance its stability and solubility in polar solvents. The hydrate designation suggests that it can associate with water molecules, influencing its physical properties such as melting point and solubility. The stereochemistry indicated by (αS)- suggests specific spatial arrangements of atoms, which can affect the compound's biological activity and interactions. Overall, this compound may have applications in medicinal chemistry or as a biochemical probe, although specific uses would depend on further research into its properties and behavior in biological systems.

Formula: C₁₇H₂₁NO₄·BrH·3H₂O

InChI: InChI=1S/C17H21NO4.BrH.3H2O/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10;;;;/h2-6,11-16,19H,7-9H2,1H3;1H;3*1H2/t11-,12-,13-,14+,15-,16+;;;;/m1..../s1

InChI key: InChIKey=LACQPOBCQQPVIT-SEYKEWMNSA-N

SMILES: CN1[C@@]2([C@]3([C@](O3)([C@]1(C[C@@H](OC([C@H](CO)C4=CC=CC=C4)=O)C2)[H])[H])[H])[H].Br.O

Synonyms:

• (1R,5S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]non-7-yl (2S)-3-hydroxy-2-phenylpropanoate hydrobromide trihydrate
• (1S,2R,4S,5S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]non-7-yl (2S)-3-hydroxy-2-phenylpropanoatato hydrobromide trihydrate
• (1S,2R,4S,5S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]non-7-yl 3-hydroxy-2-phenylpropanoate hydrobromide trihydrate
• 3-Oxa-9-azatricyclo[3.3.1.0^2,4]nonane, benzeneacetic acid deriv.
• 9-Methyl-3-Oxa-9-Azatricyclo[3.3.1.0~2,4~]Non-7-Yl 3-Hydroxy-2-Phenylpropanoate
• Atroscine hydrobromide trihydrate
• Benzeneacetic acid, α-(hydroxymethyl)-, (1α,2β,4β,5α,7β)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester, hydrobromide, hydrate (1:1:3), (αS)-
• Benzeneacetic acid, α-(hydroxymethyl)-, (1α,2β,4β,5α,7β)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester, hydrobromide, trihydrate, (αS)-
• Benzeneacetic acid, α-(hydroxymethyl)-, (1α,2β,4β,5α,7β)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0^2,4]non-7-yl ester, hydrobromide, hydrate (1:1:3), (αS)-
• Benzeneacetic acid, α-(hydroxymethyl)-, (1α,2β,4β,5α,7β)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0^2,4]non-7-yl ester, hydrobromide, trihydrate, (αS)-
• Benzeneacetic acid, α-(hydroxymethyl)-, 9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester, hydrobromide, trihydrate, [7(S)-(1α,2β,4β,5α,7β)]-
• Benzeneacetic acid, α-(hydroxymethyl)-, 9-methyl-3-oxa-9-azatricyclo[3.3.1.0^2,4]non-7-yl ester, hydrobromide, trihydrate, [7(S)-(1α,2β,4β,5α,7β)]-
• Hyoscine hydrobromide trihydrate

Scopolamine Hydrobromide Trihydrate

CAS: 114-49-8, 51-34-3, 6533-68-2

Formula: C₁₇H₂₁NO₄·HBr·3H₂O

Purity: >98.0%(T)(HPLC)

Color and Shape: White to Almost white powder to crystal

Molecular weight: 438.32

Ref: 3B-S0021

Hyoscine Hydrobromide Trihydrate

CAS: 6533-68-2

Color and Shape: Neat

Ref: 61-FOR0546.00

HYOSCINE HYDROBROMIDE CRS

CAS: 6533-68-2

HYOSCINE HYDROBROMIDE CRS

Formula: C₁₆H₂₂BrNO₃

Color and Shape: Crystalline Powder. White. Colourless. Powder.

Ref: 41-H1500000

Hyoscine hydrobromide

CAS: 6533-68-2

Hyoscine hydrobromide

Formula: C₁₇H₂₁NO₄HBr

Purity: 88.3%

Color and Shape: White

Molecular weight: 383.07322

Ref: 47-199

Scopolamine Hydrobromide

CAS: 6533-68-2

Other alkaloids,natural or reproduced by synthesis, and their salts, ethers,esters&other derivatives, nesoi

Formula: C₁₇H₂₁NO₄·HBr·xH₂O

Color and Shape: White Powder

Molecular weight: 438.31

Ref: 45-1610001

(-)-Scopolamine hydrobromide trihydrate

CAS: 6533-68-2

Formula: C₁₇H₂₁NO₄·HBr·3H₂O

Purity: (HPLC) ≥ 98.0%

Color and Shape: White or almost white powder

Molecular weight: 438.31

Ref: 7W-GL8537

Hyoscine hydrobromide, BP, Ph. Eur. grade

CAS: 6533-68-2

Formula: C₁₇H₂₁NO₄·HBr·3H₂O

Purity: ≤ 0.1%

Color and Shape: White or almost white crystalline powder, or colourless crystals

Molecular weight: 438.31

Ref: 7W-GL2191

Scopolamine-d3 HBr (Hyoscine-d3 HBr)

CAS: 6533-68-2

Formula: C₁₇H₁₈D₃NO₄·HBr

Molecular weight: 387.29

Ref: 4Z-S-011

Scopolamine-d3 HBr 3H2O(N-methyl-d3)

CAS: 1279037-70-5, 6533-68-2

Purity: 99 atom % D

Color and Shape: White Solid

Molecular weight: 387.28

Ref: 3U-D3815

Hyoscine Hydrobromide Trihydrate

Controlled Product

CAS: 6533-68-2

Formula: C₁₇H₂₁NO₄·BrHH₂O

Color and Shape: Neat

Molecular weight: 438.31

Ref: 86-MM0546.00

Scopolamine hydrobromide trihydrate

Controlled Product

CAS: 6533-68-2

Formula: C₁₇H₂₁NO₄·BrHH₂O

Color and Shape: Neat

Molecular weight: 438.31

Ref: 04-C16915000

Scopolamine Hydrobromide RS

CAS: 6533-68-2

Color and Shape: Colorless To White

Ref: 2K-1073000021

Hyoscine Hydrobromide Trihydrate

CAS: 6533-68-2

Applications Hyoscine Hydrobromide Trihydrate is used to test large-scale assessment of zebrafish embryo as possible predictive model in toxicity testing.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Ali, S., et al.: PLoS One, 6, 21076 (2011);

Formula: C₁₇H₂₁NO₄·BrH·3H₂O

Color and Shape: White Solid

Molecular weight: 438.31

Ref: TR-H674308

Scopolamine Hydrobromide Hydrate

Controlled Product

CAS: 114-49-8, 6533-68-2

Applications Scopolamine Hydrobromide Hydrate is an acetylcholine antagonist. Used in treatment of motion sickness; antiemetic; antispasmodic; mydriatic; preanesthetic medicant. Neuroprotective & Neuroresearch Product.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Brand, J.J., et al.: Lancet, 2, 232 (1970); Bowles, J.B., et al.: Anaesthesia, 34, 476 (1979); Clissold, S.P., et al.: Drugs, 29, 189 (1985); Muhtadi, F.J., et al.: Anal. Profiles Drug Subs., 19, 477 (1990);

Formula: C₁₇H₂₁NO₄·HBr·xH₂O

Color and Shape: White Solid

Molecular weight: 384.26

Ref: TR-S200000

Scopolamine-d3 Hydrobromide Hydrate

Controlled Product

CAS: 1202355-16-5, 1279037-70-5, 6533-68-2

Stability Hygroscopic
Applications An acetylcholine antagonist. Used in treatment of motion sickness; antiemetic; antispasmodic; mydriatic; preanesthetic medicant.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Brand, J.J., et al.: Lancet, 2, 232 (1970), Bowles, J.B., et al.: Anaesthesia, 34, 476 (1979), Clissold, S.P., et al.: Drugs, 29, 189 (1985), Muhtadi, F.J., et al.: Anal. Profiles Drug Subs., 19, 477 (1990),

Formula: C₁₇H₁₈D₃NO₄·BrH·xH₂O

Color and Shape: Neat

Molecular weight: 405.3

Ref: TR-S200002