Benzenamine, 4-bromo-3-ethoxy-

Basic Information

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CAS Number

125756-95-8

Molecular Formula

C8H11BrClNO

Molecular Weight

252.53 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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CCOC1=C(C=CC(=C1)N)Br.Cl

InChI

InChI=1S/C8H10BrNO.ClH/c1-2-11-8-5-6(10)3-4-7(8)9;/h3-5H,2,10H2,1H3;1H

InChIKey

CVVLNBLBIWBEPT-UHFFFAOYSA-N

LogP

2.8518000000000003

Topological Polar Surface Area

35.25 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

121

Synonyms & References

English

4-Bromo-3-ethoxyaniline hydrochloride
846023-33-4
4-Bromo-3-ethoxyaniline hydrochloride, 98.0% (T)
MFCD03790891
125756-95-8
4-bromo-3-ethoxyaniline;hydrochloride
SCHEMBL109341
PS-7452
4-Bromo-3-ethoxyaniline HCl
4-Bromo-3-ethoxyaniline, HCl
FT-0643042
CS-0167277
WIB02333
4-BROMO-3-ETHOXYANILINEHYDROCHLORIDE
AKOS015843923
CVVLNBLBIWBEPT-UHFFFAOYSA-N
AC-1577
4-bromo-3-ethoxyaniline
3-ETHOXYANILINE-4-BROMO HYDROCHLORIDE
3-ETHOXYANILINE-4-BROMOHCL
ETHYL 2-OXINDOLE-4-CARBOXYLATE
4-Bromo-3-ethoxyphenylamine
3-ETHOXY-4-BROMO ANILINE
Benzenamine, 4-bromo-3-ethoxy- (9CI)

MDL Number

MFCD03790891

FAQ

What are the physical and chemical properties of Benzenamine, 4-bromo-3-ethoxy- (CAS: 125756-95-8)?

Benzenamine, 4-bromo-3-ethoxy- (CAS: 125756-95-8) is a crystalline solid with a molecular weight of approximately 238.03 g/mol. It has a low solubility in water but is soluble in organic solvents such as ethanol and acetone. The compound is reactive towards nucleophiles and can undergo substitution reactions. It is stable under normal storage conditions but should be handled with care due to its chemical reactivity.

How is Benzenamine, 4-bromo-3-ethoxy- (CAS: 125756-95-8) typically synthesized?

Benzenamine, 4-bromo-3-ethoxy- (CAS: 125756-95-8) is typically synthesized by brominating 3-ethoxybenzene followed by reduction of the aryl bromide to the corresponding aryl alcohol using a suitable reducing agent. The reaction is carried out under anhydrous conditions to avoid side reactions. Catalysts such as palladium and ligands may be used to improve the selectivity and yield of the product.

What industries use Benzenamine, 4-bromo-3-ethoxy- (CAS: 125756-95-8)?

Benzenamine, 4-bromo-3-ethoxy- (CAS: 125756-95-8) is primarily used in the pharmaceutical industry for the synthesis of various drugs. It is also used in the production of sensors and semiconductors due to its chemical reactivity and functional groups. Additionally, it is employed in the development of new materials and polymers.

What precautions should be taken when handling Benzenamine, 4-bromo-3-ethoxy- (CAS: 125756-95-8)?

When handling Benzenamine, 4-bromo-3-ethoxy- (CAS: 125756-95-8), it is important to wear appropriate personal protective equipment (PPE) such as gloves and safety goggles. The compound should be handled in a well-ventilated area or a fume hood to minimize inhalation risk. Avoid contact with skin and eyes. Spills should be cleaned up using suitable absorbents and disposed of according to local regulations. Always consult the Safety Data Sheet (SDS) for detailed handling instructions.