3-bromo-2,2-dimethylpropan-1-ol

Basic Information

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CAS Number

40894-00-6

Molecular Formula

C5H11BrO

Molecular Weight

167.05 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Boiling Point

184-187 °C

Refractive Index

n20/D 1.479(lit.)

SMILES

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CC(C)(CO)CBr

InChI

InChI=1S/C5H11BrO/c1-5(2,3-6)4-7/h7H,3-4H2,1-2H3

InChIKey

KQOQXYPZBYTICM-UHFFFAOYSA-N

LogP

1.3998

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

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

Synonyms & References

English

DTXSID70193897
1-Propanol, 3-bromo-2,2-dimethyl-
3-Bromo-2,2-dimethyl-1-propanol, 96%
3-bromo-2,2-dimethylpropan-1-ol
BCP17392
NSC127921
MFCD00004683
CS-0043654
40894-00-6
FT-0692083
1-Propanol,3-bromo-2,2-dimethyl-
NSC 127921
A825337
AKOS015916373
SY039504
EN300-199460
SCHEMBL367694
3-bromo-2,2-dimethyl-propan-1-ol
3-bromo-2,2-dimethyl1-propanol
D97756
3 -bromo-2,2-dimethyl-1-propanol
3bromo-2,2-dimethyl-1-propanol
3-bromo-2,2-dimethylpropanol
NSC-127921
3-Bromo-2,2-dimethyl-1-propanol
3-bromo-2,2-dimethyl-1-propanol
1-Propanol,3-bromo-2,2-dimethyl
2,2-dimethyl-3-bromopropanol
3-bromanyl-2,2-dimethyl-propan-1-ol
3-bromo-2,2-dimethyl propanol
2,2-Dimethyl-3-bromo-1-propanol

MDL Number

MFCD00004683

Customs Code

2905590090

FAQ

What is 3-bromo-2,2-dimethylpropan-1-ol (CAS: 40894-00-6)?

3-Bromo-2,2-dimethylpropan-1-ol is an organic compound with the CAS number 40894-00-6. It has the chemical formula C6H11BrO and is a colorless liquid with a distinct odor. This compound is used in pharmaceuticals and as an intermediate in the synthesis of other organic compounds.

What are the main uses of 3-bromo-2,2-dimethylpropan-1-ol (CAS: 40894-00-6)?

3-Bromo-2,2-dimethylpropan-1-ol is primarily used as a synthetic intermediate in the pharmaceutical industry. It serves as a key building block in the synthesis of various drugs and other chemical compounds. This compound is also used in the production of fragrances and as a reagent in chemical research.

Is 3-bromo-2,2-dimethylpropan-1-ol (CAS: 40894-00-6) safe?

3-Bromo-2,2-dimethylpropan-1-ol is generally considered safe when handled properly. However, it is important to follow safety guidelines, including wearing appropriate protective equipment such as gloves and goggles. Ensure proper ventilation and avoid prolonged exposure. This compound should be stored in a cool, dry place away from direct sunlight and heat sources.

How should 3-bromo-2,2-dimethylpropan-1-ol (CAS: 40894-00-6) be stored?

3-Bromo-2,2-dimethylpropan-1-ol should be stored in a cool, dry place to maintain its stability. It should be kept away from direct sunlight and heat sources to prevent degradation. Store it in a tightly sealed container to avoid exposure to air and moisture. Additionally, ensure proper labeling and segregation from incompatible materials to prevent accidents and ensure safe handling.