(2S)-3-Bromo-2-methyl-1-propanol

Basic Information

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CAS Number

98244-48-5

Molecular Formula

C4H9BrO

Molecular Weight

153.02 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Boiling Point

177.5°Cat760mmHg

Density

1.461 g/mL at 25 °C

Refractive Index

n20/D 1.483(lit.)

SMILES

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CC(CO)CBr

InChI

InChI=1S/C4H9BrO/c1-4(2-5)3-6/h4,6H,2-3H2,1H3/t4-/m1/s1

InChIKey

KIBOHRIGZMLNNS-SCSAIBSYSA-N

LogP

1.0097

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

30.7

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

(S)-(+)-3-Bromo-2-methyl-1-propanol
SCHEMBL240970
98244-48-5
(2s)-3-bromo-2-methyl-1-propanol
(S)-3-bromo-2-methyl-1-propanol
(S)-2-methyl-3-bromopropanol
(S)-3-Bromo-2-methyl-propan-1-ol
1-Propanol, 3-bromo-2-methyl-, (2S)-
(2S)-3-bromo-2-methylpropan-1-ol
AS-60622
D76160
MFCD00064575
YDA24448
CS-0101486
AMY14347
DTXSID30450756
AKOS015909897
1-Propanol,3-bromo-2-methyl-,(2S)-
(S)-(+)-3-Bromo-2-methyl-1-propanol, purum, >=96.0% (sum of enantiomers, GC)
(S)-(+)-3-Bromo-2-methyl-1-propanol, 97%
3-bromo-2-(S)-methyl-1-propanol
(S)-3-Bromo-2-methylpropan-1-ol
(S)-3-bromo-2-methylpropanol
(2S)-3-Bromo-2-methyl-propan-1-ol
BDBM36058
3-Bromo-2-methyl-1-propanol #
(S)-(+)-3-BROMO-2-METHYL-1-PROPANOL
(S)-3-Bromo-2-methyl-propanol
1-Propanol,3-bromo-2-methyl-, (2S)-
(2S)-3-bromo-2-methyl-propan-1-ol

MDL Number

MFCD00064575

FAQ

What are the physical and chemical properties of (2S)-3-Bromo-2-methyl-1-propanol (CAS: 98244-48-5)?

(2S)-3-Bromo-2-methyl-1-propanol (CAS: 98244-48-5) is a colorless to light yellow crystalline solid with a molecular weight of approximately 168.02 g/mol. It has a low solubility in water but is more soluble in organic solvents like ethanol and acetone. This compound is moderately reactive, especially in the presence of strong bases or reducing agents. It can undergo electrophilic substitution reactions due to the bromine atom.

How is (2S)-3-Bromo-2-methyl-1-propanol (CAS: 98244-48-5) typically synthesized?

(2S)-3-Bromo-2-methyl-1-propanol (CAS: 98244-48-5) is typically synthesized via bromination of 2-methyl-1-propanol using a phase transfer catalyst in an organic solvent. The reaction requires a controlled environment to maintain selectivity and yield. Commonly, this involves the use of a strong base like sodium hydride in a polar aprotic solvent such as N,N-dimethylformamide (DMF) or dimethyl sulfoxide (DMSO).

What industries use (2S)-3-Bromo-2-methyl-1-propanol (CAS: 98244-48-5)?

(2S)-3-Bromo-2-methyl-1-propanol (CAS: 98244-48-5) is used in the pharmaceutical industry for the synthesis of various organic compounds due to its bromine substituent. It also finds applications in the production of certain polymers and as a reagent in the development of chemical sensors and semiconductors.

What precautions should be taken when handling (2S)-3-Bromo-2-methyl-1-propanol (CAS: 98244-48-5)?

When handling (2S)-3-Bromo-2-methyl-1-propanol (CAS: 98244-48-5), it is crucial to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a fume hood to minimize exposure. Spills should be cleaned up using absorbent materials, and proper disposal methods should be followed. Always refer to the Safety Data Sheet (SDS) for detailed instructions and emergency procedures.