1-Bromoadamantane

Basic Information

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CAS Number

768-90-1

Molecular Formula

C10H15Br

Molecular Weight

215.13 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

118.0 to 121.0 deg-C

Boiling Point

240.5°C at 760 mmHg

Density

1.2686 (rough estimate)

Water Solubility

It is soluble in organic solvents and insoluble in water.

Flash Point

96.4℃

Refractive Index

1.6411 (estimate)

SMILES

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C1C2CC3CC1CC(C2)(C3)Br

InChI

InChI=1S/C10H15Br/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6H2

InChIKey

VQHPRVYDKRESCL-UHFFFAOYSA-N

LogP

3.350100000000002

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

144

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Sensitiveness

Moisture Sensitive

Synonyms & References

English

tricyclo[3.3.1.1~3,7~]decane, 1-bromo-
1-Bromotricyclo(3.3.1.13,7)decane
EINECS 212-200-7
EINECS 230-777-3
ADAMANTANE,1-BROMO
AS-49983
AH-034/32472047
B0390
bromoadmantane
NSC-527914
UNII-GKV2KDH3R5
1-Bromoadamantane (purified by sublimation)
BTB 13004
O10392
Adamantyl bromide
1-Adamantyl bromide
A840071
2-Bromotricyclo(3.3.1.13,7)decane
1-Bromoadamantane
1-Bromo-adamantane
HY-W008594
1-Bromoadamanthane
1-Bromoadamantane, 99%
NSC527914
768-90-1
Bromoadamantane
AKOS003152221
Q2806575
MFCD00074721
SCHEMBL258925
AKOS002262893

MDL Number

MFCD00074721

Customs Code

29035990

FAQ

What is 1-Bromoadamantane (CAS: 768-90-1)?

1-Bromoadamantane (CAS: 768-90-1) is a brominated derivative of adamantane, a polycyclic hydrocarbon with a highly symmetrical structure. Its chemical formula is C10H15Br, and it is a solid at room temperature with a molecular weight of approximately 193.16 g/mol. The compound exhibits low solubility in water but is soluble in organic solvents. It is widely recognized for its stability and unique carbon framework, making it a valuable intermediate in organic synthesis and pharmaceutical research.

What are the main uses of 1-Bromoadamantane (CAS: 768-90-1)?

1-Bromoadamantane (CAS: 768-90-1) is primarily used as a key precursor in the synthesis of antiviral drugs, such as rimantadine, and other pharmaceutical compounds. It also finds applications in organic chemistry research, material science, and as a building block for creating complex molecules. Due to its structural rigidity and reactivity, it is utilized in industrial processes involving bromination reactions and functional group modifications.

Is 1-Bromoadamantane (CAS: 768-90-1) safe?

1-Bromoadamantane (CAS: 768-90-1) requires careful handling due to its potential toxicity. It is classified as a hazardous substance, with inhalation or ingestion posing health risks. Safety precautions include wearing protective gloves, goggles, and respirators when working with the compound. It should be stored in a well-ventilated area and handled in accordance with OSHA and EPA guidelines to minimize exposure and ensure workplace safety.

How should 1-Bromoadamantane (CAS: 768-90-1) be stored?

1-Bromoadamantane (CAS: 768-90-1) should be stored in a sealed, airtight container in a cool (2-8°C), dry, and dark environment to maintain stability. It is sensitive to moisture and air, so desiccant packaging is recommended. Avoid exposure to light and incompatible materials. Proper storage ensures long-term preservation and reduces the risk of chemical degradation or hazardous reactions.