Tropine | CAS No. 120-29-6

Tropine

Basic Information

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CAS Number

120-29-6

Molecular Formula

C8H15NO

Molecular Weight

141.21 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Physical State

Powder

Melting Point

62-64 ºC

Boiling Point

233°C at 760 mmHg

Water Solubility

100 g/L (20 ºC)

Flash Point

232-234℃

Solubility

H2O: 0.1 g/mL, clear

Refractive Index

1.4811 (estimate)

Vapor Pressure

0.0±1.3 mmHg at 25°C

SMILES

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CN1C2CCC1CC(C2)O

InChI

InChI=1S/C8H15NO/c1-9-6-2-3-7(9)5-8(10)4-6/h6-8,10H,2-5H2,1H3

InChIKey

CYHOMWAPJJPNMW-UHFFFAOYSA-N

LogP

0.6039000000000001

pKa

3.80(at 15℃)

Topological Polar Surface Area

23.47 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

123

Safety Information

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Hazard Statement

Hazard Class

Class 6.1(b) Class 6.1(b)

Storage Conditions

2-8℃

Sensitiveness

Hygroscopic

Synonyms & References

English

rel-(1R,3s,5S)-8-Methyl-8-azabicyclo[3.2.1]octan-3-ol
CAS-120-29-6
3beta-Tropanol
(1R,3r,5S)-8-Methyl-8-azabicyclo[3.2.1]oct-3-ol (Tropine)
Tropine, >=97.0% (NT)
120-29-6
A-804485
tropan-3alpha-ol
endo-8-methyl-8-azabicyclo[3.2.1]octan-3-ol
DTXCID9029358
exo-8-Methyl-8-azabicyclo(3.2.1)octan-3-ol
2,3-Dihydro-3alpha-hydroxytropidine
ENDO-8-METHYL-8-AZABICYCLO(3.2.1)OCTAN-3-OL
NS00073198
Tropine
NSC 43871
Pseudotropine
8-Azabicyclo(3.2.1)octan-3-ol, 8-methyl-, exo-
HMS3886K07
5-21-01-00219 (Beilstein Handbook Reference)
PSEUDOTROPINE [MI]
NCGC00016370-01
1alphaH,5alphaH-Tropan-3beta-ol
TROPINE [MI]
CS-0078616
TROPINE [EP IMPURITY]
7YXR19M72Y
Tropisetron Hydrochloride Imp. A (EP); Tropisetron Imp. A (EP); (1R,3r,5S)-8-Methyl-8-azabicyclo[3.2.1]oct-3-ol; Tropine; Tropisetron Hydrochloride Impurity A; Tropisetron Impurity A
NS00015118
1alphaH,5alphaH-Tropan-3alpha-ol
135-97-7

MDL Number

MFCD00005551

Customs Code

2933990090

FAQ

What is Tropine (CAS: 120-29-6)?

Tropine is a naturally occurring alkaloid with the chemical formula C17H23NO3. It is derived from plants in the nightshade family and is known for its complex structure and various biological activities. Tropine is a white to light yellow crystalline solid, typically found in extracts from plants like Datura and Brugmansia. It has a molecular weight of 297.36 g/mol and is soluble in organic solvents.

What are the main uses of Tropine (CAS: 120-29-6)?

Tropine is primarily used in pharmaceutical research as a precursor to synthetic compounds such as scopolamine and hyoscyamine. It has applications in medicinal chemistry for developing drugs targeting the parasympathetic nervous system. In research settings, tropine is also used to study alkaloid chemistry and its effects on biological systems. Additionally, it may appear in some industrial or analytical applications, though its use is largely restricted to controlled environments.

Is Tropine (CAS: 120-29-6) safe?

Tropine is generally considered safe when used in controlled and appropriate conditions. However, it is important to note that it is a precursor to more potent alkaloids and can be toxic if misused or exposed in high concentrations. Handling should be done with care, using protective gloves and eyewear. Safety standards for tropine are typically outlined in guidelines for handling alkaloids and should be followed to minimize health risks.

How should Tropine (CAS: 120-29-6) be stored?

Tropine should be stored in a cool, dry, and dark place, away from moisture and light. It is best kept in a sealed container at a temperature below 25°C. Storage in airtight containers is recommended to maintain stability and prevent degradation. Proper storage conditions help ensure the chemical remains safe and effective for use in research or pharmaceutical applications.