1-bromo-3-chloro-2-methylpropane

Basic Information

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CAS Number

6974-77-2

Molecular Formula

C4H8BrCl

Molecular Weight

171.46 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Boiling Point

154°C

Density

1.467 g/mL at 25 °C

Flash Point

>230 °F

Refractive Index

n20/D 1.4809(lit.)

SMILES

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CC(CCl)CBr

InChI

InChI=1S/C4H8BrCl/c1-4(2-5)3-6/h4H,2-3H2,1H3

InChIKey

ZKDOQFPDSUOLGF-UHFFFAOYSA-N

LogP

2.2562000000000006

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

30.7

Safety Information

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GHS Hazard Pictograms

H303

Hazard Statement

H303 May be harmful if swallowed
Acute toxicity, oral

Hazard Class

Class 6.1(b) Class 6.1(b)

Synonyms & References

English

NSC21695
GS-3351
MFCD00000955
EINECS 230-224-6
FT-0607480
Isoxazole, 3-(3-methylphenyl)-5-phenyl-
W-110187
CS-0204235
NSC-21695
2-Methyl-1-chloro-3-bromopropane
NSC 21695
3-Bromo-2-methyl-1-chloropropane
6974-77-2
1-bromo-2-methyl-3-chloro-propane
.+/-.-1-Bromo-3-chloro-2-methylpropane
Propane, 1-bromo-3-chloro-2-methyl-
2-Methyl-1-bromo-3-chloropropane
B1859
DTXSID40871175
1-bromo-3-chloro-2-methyl-propane
1-Bromo-2-methyl-3-chloropropane
EN300-77158
AKOS006227960
E78852
NS00044440
1-chloro-3-bromo-2-methylpropane
SCHEMBL606834
SY053242
1-Bromo-3-chloro-2-methylpropane
3-bromo-1-chloro-2-methylpropane
1-Chloro-2-Methyl-3-Bromopropane

MDL Number

MFCD00000955

Customs Code

2903799090

FAQ

What is 1-bromo-3-chloro-2-methylpropane (CAS: 6974-77-2)?

1-Bromo-3-chloro-2-methylpropane is an organic compound with the CAS number 6974-77-2. It is a colorless to yellowish liquid with a strong, unpleasant odor. The molecular formula is C5H8BrCl and it has a boiling point of 129.7°C and a density of 1.38 g/cm³.

What are the main uses of 1-bromo-3-chloro-2-methylpropane (CAS: 6974-77-2)?

1-Bromo-3-chloro-2-methylpropane is primarily used as an intermediate in the synthesis of pharmaceuticals and agrochemicals. It is also used as a reagent in organic synthesis and as a solvent in some applications. In the laboratory, it serves as a useful reaction intermediate due to its bromo and chloro substituents.

Is 1-bromo-3-chloro-2-methylpropane (CAS: 6974-77-2) safe?

1-Bromo-3-chloro-2-methylpropane is generally safe when handled with appropriate precautions. It should be used in well-ventilated areas to avoid inhalation of vapors. Protective equipment such as gloves and goggles should be worn. It is important to store it away from heat and sources of ignition. Ingestion, skin contact, and inhalation can cause irritation and potential hazards.

How should 1-bromo-3-chloro-2-methylpropane (CAS: 6974-77-2) be stored?

1-Bromo-3-chloro-2-methylpropane should be stored in a cool, dry place, away from heat and sources of ignition. It should be kept in a tightly sealed container to prevent evaporation and contamination. The storage area should have good ventilation to minimize the risk of inhalation of vapors. It is also recommended to keep it away from incompatible substances such as alkalis, metals, and oxidizers.